4-hydroxy-7-methyl-2-oxo-N-(4-phenoxyphenyl)-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-(4-phenoxyphenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
4-hydroxy-7-methyl-2-oxo-N-(4-phenoxyphenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | M435-1438 |
| Compound Name: | 4-hydroxy-7-methyl-2-oxo-N-(4-phenoxyphenyl)-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide |
| Molecular Weight: | 446.52 |
| Molecular Formula: | C25 H22 N2 O4 S |
| Smiles: | CC1CCc2c3C(=C(C(Nc4ccc(cc4)Oc4ccccc4)=O)C(Nc3sc2C1)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0758 |
| logD: | 1.3946 |
| logSw: | -4.7847 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.849 |
| InChI Key: | ITOXLGYECKVPPX-CQSZACIVSA-N |