N-(4-bromo-3-methylphenyl)-1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carboxamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carboxamide
N-(4-bromo-3-methylphenyl)-1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carboxamide
Compound characteristics
| Compound ID: | G539-0050 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-1-phenyl-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-c]pyridine-2(1H)-carboxamide |
| Molecular Weight: | 481.45 |
| Molecular Formula: | C25 H25 Br N2 O S |
| Smiles: | Cc1cc(ccc1[Br])NC(N1CCc2c3CCCCc3sc2C1c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5416 |
| logD: | 7.5416 |
| logSw: | -5.5517 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.6211 |
| InChI Key: | HAEMZPQCUFDKKE-HSZRJFAPSA-N |