4-hydroxy-7-methyl-2-oxo-N-[3-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Chemical Structure Depiction of
4-hydroxy-7-methyl-2-oxo-N-[3-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
4-hydroxy-7-methyl-2-oxo-N-[3-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | M435-1483 |
| Compound Name: | 4-hydroxy-7-methyl-2-oxo-N-[3-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide |
| Molecular Weight: | 438.42 |
| Molecular Formula: | C20 H17 F3 N2 O4 S |
| Smiles: | CC1CCc2c3C(=C(C(Nc4cccc(c4)OC(F)(F)F)=O)C(Nc3sc2C1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5758 |
| logD: | 0.8946 |
| logSw: | -4.5858 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.038 |
| InChI Key: | SNLOUKQCVCJLJS-SECBINFHSA-N |