N-(3-chloro-4-methoxyphenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
N-(3-chloro-4-methoxyphenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | M435-1231 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide |
| Molecular Weight: | 404.87 |
| Molecular Formula: | C19 H17 Cl N2 O4 S |
| Smiles: | COc1ccc(cc1[Cl])NC(C1=C(c2c3CCCCc3sc2NC1=O)O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4623 |
| logD: | -0.2189 |
| logSw: | -3.8172 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.732 |
| InChI Key: | HJBFIRAFWHTXDA-UHFFFAOYSA-N |