3-chloro-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide
3-chloro-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | 3616-1932 |
Compound Name: | 3-chloro-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]-1-benzothiophene-2-carboxamide |
Molecular Weight: | 405.86 |
Molecular Formula: | C21 H12 Cl N3 O2 S |
Smiles: | c1ccc2c(c1)c(c(C(Nc1ccc3c(c1)nc(c1ccncc1)o3)=O)s2)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.9482 |
logD: | 4.9457 |
logSw: | -5.2744 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 50.315 |
InChI Key: | JXIKTIIILGHUJA-UHFFFAOYSA-N |