2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | 4296-0295 |
| Compound Name: | 2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 423.46 |
| Molecular Formula: | C22 H18 F N3 O3 S |
| Smiles: | C1CC2=C(C(C(C#N)=C(N2)SCC(Nc2ccc(cc2)F)=O)c2ccco2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.282 |
| logD: | 0.3914 |
| logSw: | -3.6952 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.125 |
| InChI Key: | WUCRABBQCZIWLL-HXUWFJFHSA-N |