Discovery of P7C3-A20

Reference of 1235481-90-9, One of the oldest and most widely used commercial enzyme inhibitors is aspirin, which selectively inhibits one of the enzymes involved in the synthesis of molecules that trigger inflammation. you can also check out more blogs about 1235481-90-9.

Reference of 1235481-90-9, As an important bridge between the micro and macro material world, chemistry is one of the main methods and means for humans to understand and transform the material world. 1235481-90-9, Name is P7C3-A20, SMILES is COC1=CC(NCC(F)CN2C3=C(C4=C2C=CC(Br)=C4)C=C(Br)C=C3)=CC=C1, belongs to benzoxazole compound. In a article, author is Aydin, Abdullah, introduce new discover of the category.

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.

Reference of 1235481-90-9, One of the oldest and most widely used commercial enzyme inhibitors is aspirin, which selectively inhibits one of the enzymes involved in the synthesis of molecules that trigger inflammation. you can also check out more blogs about 1235481-90-9.

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