Tag: M.W:200-300

Reference of 5471-63-6, Redox catalysis has been broadly utilized in electrochemical synthesis due to its kinetic advantages over direct electrolysis. The appropriate choice of redox mediator can avoid electrode passivation and overpotential. 5471-63-6, Name is 1,3-Diphenylisobenzofuran, SMILES is C1(C2=CC=CC=C2)=C3C=CC=CC3=C(C4=CC=CC=C4)O1, belongs to benzoxazole compound. In a article, author is Jilani, Jamal Abdellatif, introduce new discover of the category.

SYNTHESIS, CHARACTERIZATION AND BIOLOGICAL EVALUATION OF SOME 2-ARYLBENZOXAZOLE ACETIC ACID DERIVATIVES AS PROMISING ANTICANCER AGENTS

The synthesis of a series of 2-arylbenzoxazole compounds possessing a cytotoxic activity as potential anticancer agents was achieved. Oxidative coupling of benzaldehyde with o-aminophenol utilizing lead tetraacelate approach was used to realize the synthesis of compounds 1-11. The cytotoxicity of 1-11 was screened against breast cancer cell line MCF-7 and human colon cancer cell line HCT-116 utilizing doxorubicin as a reference drug. Among these compounds, 2-(3-benzyloxyphenyl)benzoxazole-5-acetic acid (5) and 2-(4-methoxyphenyl)benzoxazol-5-acetic acid (10), were found to be promising cytotoxic compounds against the MCF-7 cell line. In addition, this study showed that the presence of an acetic acid group at position 5 of the benzoxazole nucleus enhances the activity. Moreover, we noticed that the presence of an oxygen atom directly linked to the phenyl substituent improves activity as well. These results offer a new benzoxazole based template to design and develop novel antineoplastic agents.

Reference of 5471-63-6, Consequently, the presence of a catalyst will permit a system to reach equilibrium more quickly, but it has no effect on the position of the equilibrium as reflected in the value of its equilibrium constant.I hope my blog about 5471-63-6 is helpful to your research.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Application of 22439-61-8, Enzymes are biological catalysts that produce large increases in reaction rates and tend to be specific for certain reactants and products. 22439-61-8, Name is 2-Bromodibenzo[b,d]thiophene, SMILES is BrC1=CC2=C(SC3=CC=CC=C23)C=C1, belongs to benzoxazole compound. In a article, author is Megala, M., introduce new discover of the category.

Heteroaromatic rings as linkers for quercetin-based dye-sensitized solar cell applications: a TDDFT investigation

The electronic properties of quercetin (Q)-pi-cyanoacrylic acid (CNA) dye molecules using heteroaromatic rings, namely cyclopentadiene (F1), furan (F2), pyrrole (F3), thiophene (F4), oxazole (F5), imidazole (F6), thiazole (F7), isoindene (FF1), benzofuran (FF2), indole (FF3), benzothiophene (FF4), benzoxazole (FF5), benzimidazole (FF6), and benzothiazole (FF7), as pi-linkers are studied for the first time using Time-Dependent Density Functional Theory (TDDFT) with dimethyl sulfoxide (DMSO) as solvent to predict their excitation energy, absorption wavelength, oscillator strength, light harvesting efficiency, and exciton binding energy. The charge transfer and charge regeneration in the ground and excited states of the dyes are established. The photon to electron energy transfer from the dye (quercetin) to the semiconductor (TiO2) surface is analyzed based on intramolecular charge transfer. The results of the electron transfer studies on these newly designed dyes could be used to enhance the performance of resulting dye-sensitized solar cells.

Application of 22439-61-8, Consequently, the presence of a catalyst will permit a system to reach equilibrium more quickly, but it has no effect on the position of the equilibrium as reflected in the value of its equilibrium constant.I hope my blog about 22439-61-8 is helpful to your research.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

One of the major reasons for studying chemical kinetics is to use measurements of the macroscopic properties of a system, such as the rate of change in the concentration of reactants or products with time. 94790-35-9, Name is N-(Chloro(dimethylamino)methylene)-N-methylmethanaminium hexafluorophosphate(V), formurla is C5H12ClF6N2P. In a document, author is Safaei, Elham, introducing its new discovery. Recommanded Product: 94790-35-9.

Stabilization of different redox levels of a tridentate benzoxazole amidophenoxide ligand when bound to Co(iii) or V(v)

A tridentate benzoxazole-containing aminophenol ligand NNOH2 was coordinated to Co and V metal centers and the electronic structure of the resultant complexes characterized by both experimental and theoretical methods. The solid state structure of the Co complex exhibits a distorted octahedral geometry with two tridentate ligands bound in meridional fashion, and coordination-sphere bond lengths consistent with a Co(iii) oxidation state. EPR and magnetic data support a S = 1/2 ground state, and a formal electronic description of Co(iii)(NNOAP)(NNOISQ) where NNOAP corresponds to an amidophenoxide and NNOISQ to the iminosemiquinone redox level. However, the metrical parameters are similar for both ligands in the solid state, and DFT calculations support delocalization of the ligand radical over both ligands, affording an intermediate ligand redox level Co(iii)(NNO1.5-)(NNO1.5-). The vanadyl complex exhibits a distorted octahedral geometry in the solid state consistent with a V(v) metal center and amidophenoxide (NNOAP), acetylacetonate and oxo ligands. The ligand metrical parameters are consistent with significant amidophenoxide to V(v) pi donation. Overall, our results highlight the roles of electron transfer, delocalization, and pi bonding in the metal complexes under study, and thus the complexity in assignment of the electronic structure in these systems.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

A catalyst don’t appear in the overall stoichiometry of the reaction it catalyzes, but it must appear in at least one of the elementary reactions in the mechanism for the catalyzed reaction. 345-92-6, Name is Bis(4-Fluorophenyl)methanone, molecular formula is C13H8F2O. In an article, author is El-Helby, Abdel-Ghany A.,once mentioned of 345-92-6, Computed Properties of https://www.ambeed.com/products/345-92-6.html.

Design, synthesis, molecular docking, and anticancer activity of benzoxazole derivatives as VEGFR-2 inhibitors

Novel series of benzoxazoles 4(a-f)-16 were designed, synthesized, and evaluated for anticancer activity against HepG2, HCT-116, and MCF-7 cells. HCT-116 was the most sensitive cell line to the influence of the new derivatives. In particular, compound 5(e) was found to be the most potent against HepG2, HCT-116, and MCF-7 with IC50 = 4.13 +/- 0.2, 6.93 +/- 0.3, and 8.67 +/- 0.5 mu M, respectively. Compounds 5(c), 5(f), 6(b), 5(d), and 6(c) showed the highest anticancer activities against HepG2 cells with IC50 of 5.93 +/- 0.2, 6.58 +/- 0.4, 8.10 +/- 0.7, 8.75 +/- 0.7, and 9.95 +/- 0.9 mu M, respectively; HCT-116 cells with IC50 of 7.14 +/- 0.4, 9.10 +/- 0.8, 7.91 +/- 0.6, 9.52 +/- 0.5, and 12.48 +/- 1.1 mu M, respectively; and MCF-7 cells with IC50 of 8.93 +/- 0.6, 10.11 +/- 0.9, 12.31 +/- 1.0, 9.95 +/- 0.8, and 15.70 +/- 1.4 mu M, respectively, compared with sorafenib as a reference drug with IC50 of 9.18 +/- 0.6, 5.47 +/- 0.3, and 7.26 +/- 0.3 mu M, respectively. The most active compounds 5(c-f) and 6(b,c) were further evaluated for their vascular endothelial growth factor receptor-2 (VEGFR-2) inhibition. Compounds 5(e) and 5(c) potently inhibited VEGFR-2 at lower IC50 values of 0.07 +/- 0.01 and 0.08 +/- 0.01 mu M, respectively, compared with sorafenib (IC50 = 0.1 +/- 0.02 mu M). Compound 5(f) potently inhibited VEGFR-2 at low IC50 value (0.10 +/- 0.02 mu M) equipotent to sorafenib. Our design was based on the essential pharmacophoric features of the VEGFR-2 inhibitor sorafenib. Molecular docking was performed for all compounds to assess their binding pattern and affinity toward the VEGFR-2 active site.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

The reaction rate of a catalyzed reaction is faster than the reaction rate of the uncatalyzed reaction at the same temperature. Name: Bis(4-Fluorophenyl)methanone, 345-92-6, Name is Bis(4-Fluorophenyl)methanone, SMILES is FC1=CC=C(C=C1)C(=O)C1=CC=C(F)C=C1, in an article , author is Liu, Shuang, once mentioned of 345-92-6.

The effect of benzoxazole unit on the properties of cyclic thiourea functionalized triphenylamine dye sensitizers

Two D-pi-A-A sensitizers (AZ6-B20 and AZ6-B21) were synthesized by inserting the benzoxazole group as an auxiliary acceptor between the pi-linker and the acceptor. And a D-A-pi-A sensitizer (AZ6-B19) was also synthesized in our previous works by the insertion of the benzoxazole between the donor and the pi-linker. The effects of benzoxazole groups on the properties at different sites of dye sensitizers were distinguishing. Their light harvest abilities were investigated by UV-vis spectra both in the solution and on the films. The results show that the absorption bands of UV-vis spectra are quite different from D-A-pi-A and D-pi-A-A dyes. The much more intensive molar extinction coefficients (53807 M-1 cm(-1) and 52555 M-1 cm(-1)) were observed at around 575 nm for D-pi-A-A dyes. The photovoltaic properties of DSSCs were also evaluated by J-V curves and IPCE measurements. The results confirmed that D-pi-A-A dyes delivered high photovoltaic efficiency (AZ6-B20: 7.48%, AZ6-B21: 8.67%) compared with that of D-A-pi-A dye (AZ6-B19: 3.27%). The details on the relation of the structures/ properties were discussed by the optical physical absorption, electrical chemical measurements and DFT calculations.

But sometimes, even after several years of basic chemistry education, it is not easy to form a clear picture on how they govern reactivity! 345-92-6, you can contact me at any time and look forward to more communication. Name: Bis(4-Fluorophenyl)methanone.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

One of the major reasons for studying chemical kinetics is to use measurements of the macroscopic properties of a system, such as the rate of change in the concentration of reactants or products with time. 1714-29-0, Name is 1-Bromopyrene, formurla is C16H9Br. In a document, author is Wu, Yu-Ran, introducing its new discovery. Formula: https://www.ambeed.com/products/1714-29-0.html.

Synthesis and anticholinesterase activities of novel glycosyl benzoxazole derivatives

Eight glycosyl benzoxazole derivatives are synthesized by nucleophilic addition reactions of glycosyl isothiocyanate witho-aminophenol in tetrahydrofuran. The reaction conditions are optimized, and good yields (86%-94%) were obtained. The structures of all new products are confirmed by infrared,H-1 nuclear magnetic resonance, and high-resolution mass spectrometry (electrospray ionization). In addition, the in vitro cholinesterase inhibitory activities of these new compounds are tested by Ellman’s method.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

In an article, author is Boutin, Jean A., once mentioned the application of 22439-61-8, Category: benzoxazole, Name is 2-Bromodibenzo[b,d]thiophene, molecular formula is C12H7BrS, molecular weight is 263.15, MDL number is MFCD00089285, category is benzoxazole. Now introduce a scientific discovery about this category.

Melatonin receptor ligands: A pharmaco-chemical perspective

Melatonin MT(1)and MT(2)receptor ligands have been vigorously explored for the last 4 decades. Inspection of approximately 80 publications in the field revealed that most melatonergic ligands were structural analogues of melatonin combining three essential features of the parent compound: an aromatic ring bearing a methoxy group and an amide side chain in a relative arrangement similar to that present in melatonin. While several series of MT2-selective agents-agonists, antagonists, or partial agonists-were reported, the field was lacking MT1-selective agents. Herein, we describe various approaches toward the development of melatonergic ligands, keeping in mind that most of the molecules/pharmacophores obtained were essentially melatonin copies, even though diverse tri- or tetra-cyclic compounds were explored. In addition to lack of structural diversity, only few studies examined the activity of the reported melatonergic ligands in vivo. Moreover, an extensive pharmacological characterization including biopharmaceutical stability, pharmacokinetic properties, specificity toward other major receptors to name a few remained scarce. For example, many of the antagonists described were not stable in vivo, were not selective for the melatonin receptor subtype of interest, and were not fully characterized from a pharmacological standpoint. Indeed, virtual screening of large compound libraries has led to the recent discovery of potent and selective melatonin receptor agonists and partial agonists of new chemotypes. Having said this, the melatonergic field is still lacking subtype-selective melatonin receptor antagonists active in vivo, which are critical to our understanding of melatonin and melatonin receptors’ role in basic physiology and disease.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Application of 165534-43-0, The transformation of simple hydrocarbons into more complex and valuable products via catalytic C–H bond functionalisation has revolutionised modern synthetic chemistry. 165534-43-0, Name is Diethyl (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl) phosphate, SMILES is O=P(OCC)(OCC)ON1N=NC2=CC=CC=C2C1=O, belongs to benzoxazole compound. In a article, author is Omar, A. Mohsen M. E., introduce new discover of the category.

Benzoxazole derivatives as new generation of anti-breast cancer agents

New 2-substituted benzoxazole derivatives were synthesized and screened for their in vitro anti-proliferative activities against MCF-7 and MDA-MB-231 cell lines. Compounds 4b, 4d and 11c eliciting the highest activity against MCF-7 cells were further assayed for their cytotoxic activities against A431 and HCC827 cancer cells in addition to their in vitro inhibition of wild and mutated epidermal growth factor receptor (EGFR) enzymes. Compound 11c was the most active against A431 cells and it displayed a potent inhibition of EGFR(WT) while compounds 4b and 4d elicited higher potencies than erlotinib against mutated EGFR(L858R). Compounds 4a, 6c and 8a showed the most potent cytotoxic activity against MDA-MB-231 cancer cells where compounds 4a and 6c were slightly less potent aromatase (ARO) inhibitors than letrozole. MCF-7 cells treated with compounds 4b, 4d, 11c and MDA-MB-231 cells treated with compounds 4a, 6c and 8a showed remarkable over-expression of caspase-9 protein level and elicited pre G1 apoptosis and cell cycle arrest at G2/M phase in addition to high annexin V binding affinity indicating significant apoptosis. Chemo-informatic and docking properties were also predicted. Docking results revealed that docked compounds displayed binding modes with EGFR and ARO enzymes comparable to that of the reference ligands. The benzoxazole derivatives 11c and 6c possessing amide and dithiocarbamate moieties respectively were found to be potent apoptosis-inducing anti-breast cancer agents with acceptable physicochemical properties. They exert their activity via inhibition of EGFR and ARO enzymes respectively.

Application of 165534-43-0, The reactant in an enzyme-catalyzed reaction is called a substrate. Enzyme inhibitors cause a decrease in the reaction rate of an enzyme-catalyzed reaction.I hope my blog about 165534-43-0 is helpful to your research.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Chemistry is the experimental science by definition. We want to make observations to prove hypothesis. For this purpose, we perform experiments in the lab. , Product Details of 165534-43-0, 165534-43-0, Name is Diethyl (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl) phosphate, molecular formula is C11H14N3O5P, belongs to benzoxazole compound. In a document, author is Aydin, Abdullah, introduce the new discover.

Crystal structure and Hirshfeld surface analysis of 2-[(1,3-benzoxazol-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide

In the title compound, C16H14N2O3S, the 1,3-benzoxazole ring system is essentially planar (r.m.s deviation = 0.004 angstrom) and makes a dihedral angle of 66.16 (17)degrees with the benzene ring of the methoxyphenyl group. Two intramolecular N -H center dot center dot center dot O and N -H center dot center dot center dot N hydrogen bonds occur, forming S(5) and S(7) ring motifs, respectively. In the crystal, pairs of C-H center dot center dot center dot O hydrogen bonds link the molecules into inversion dimers with R-2(2)(14) ring motifs, stacked along the b-axis direction. The inversion dimers are linked by C-H center dot center dot center dot-pi and pi-pi-stacking interactions [centroid-to-centroid distances = 3.631 (2) and 3.631 (2) angstrom], forming a three-dimensional network. Two-dimensional fingerprint plots associated with the Hirshfeld surface show that the largest contributions to the crystal packing come from H center dot center dot center dot H (39.3%), C center dot center dot center dot-H/H center dot center dot center dot C (18.0%), O center dot center dot center dot H/H center dot center dot center dot O (15.6) and S center dot center dot center dot H/H center dot center dot center dot S (10.2%) interactions.

A reaction mechanism is the microscopic path by which reactants are transformed into products. Each step is an elementary reaction. In my other articles, you can also check out more blogs about 165534-43-0. Product Details of 165534-43-0.

Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem

Related Products of 165534-43-0, Children learn through play, and they learn more than adults might expect. Science experiments are a great way to spark their curiosity, 165534-43-0, Name is Diethyl (4-oxobenzo[d][1,2,3]triazin-3(4H)-yl) phosphate, SMILES is O=P(OCC)(OCC)ON1N=NC2=CC=CC=C2C1=O, belongs to benzoxazole compound. In a article, author is Song, Ming-Xia, introduce new discover of the category.

Design, synthesis, and evaluation of anticonvulsant activities of benzoxazole derivatives containing the 1,2,4-triazolone moiety

A novel series of benzoxazole derivatives containing 1,2,4-triazolone (5a-m) was designed. These compounds were synthesized in order to screen their anticonvulsant activities by the maximal electroshock seizure (MES) model and the subcutaneous pentylenetetrazole (sc-PTZ) seizure model in mice. The rotarod test was used to evaluate their neurotoxicities. Most of the compounds showed anti-MES activities at 100 and 300 mg/kg. Compound 5f, which showed potential anticonvulsant activity in the MES model with ED50 values of 22.0 mg/kg, was considered as the most promising one in this study. It exhibited greater safety than that of carbamazepine and valproate regarding neurotoxicity. The efficacy of compound 5f in inhibiting the tonic seizures and death induced by the convulsants 3-mercaptopropionic acid and BIC was also verified. In an enzyme-linked immunosorbent assay, compound 5f and the positive drug phenytoin significantly increased the gamma-aminobutyric acid (GABA) level in the mouse brain. Further, pretreatment with an inhibitor of the GABA synthesizing enzyme dramatically raised the ED50 value of 5f in the MES model. These results confirmed that the compound 5f plays its anticonvulsive action via regulating the GABA function in the brain. Also, a docking study of the compound 5f in the benzodiazepine (BZD) binding site of the GABA(A) receptor confirmed possible binding of the compound 5f with BZD receptors.

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Reference:
Benzoxazole – Wikipedia,
,Benzoxazole | C7H5NO – PubChem