N-(3-chlorophenyl)-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
N-(3-chlorophenyl)-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Compound characteristics
Compound ID: | M435-1428 |
Compound Name: | N-(3-chlorophenyl)-4-hydroxy-7-methyl-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide |
Molecular Weight: | 388.87 |
Molecular Formula: | C19 H17 Cl N2 O3 S |
Smiles: | CC1CCc2c3C(=C(C(Nc4cccc(c4)[Cl])=O)C(Nc3sc2C1)=O)O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.1392 |
logD: | 0.458 |
logSw: | -4.371 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 63.101 |
InChI Key: | CAVAJTHPSYMUOA-SECBINFHSA-N |