N-(3-chloro-4-fluorophenyl)-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-fluorophenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
N-(3-chloro-4-fluorophenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | M435-1213 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-4-hydroxy-2-oxo-1,2,5,6,7,8-hexahydro[1]benzothieno[2,3-b]pyridine-3-carboxamide |
| Molecular Weight: | 392.83 |
| Molecular Formula: | C18 H14 Cl F N2 O3 S |
| Smiles: | C1CCc2c(C1)c1C(=C(C(Nc3ccc(c(c3)[Cl])F)=O)C(Nc1s2)=O)O |
| Stereo: | ACHIRAL |
| logP: | 3.6819 |
| logD: | 0.0007 |
| logSw: | -4.1113 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.101 |
| InChI Key: | VVQWSWWRWFSTLG-UHFFFAOYSA-N |