N-(4-chloro-2,5-dimethoxyphenyl)-2-{[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-chloro-2,5-dimethoxyphenyl)-2-{[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
N-(4-chloro-2,5-dimethoxyphenyl)-2-{[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 4296-0432 |
| Compound Name: | N-(4-chloro-2,5-dimethoxyphenyl)-2-{[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 514 |
| Molecular Formula: | C25 H24 Cl N3 O5 S |
| Smiles: | Cc1ccc(C2C(C#N)=C(NC3CCCC(C2=3)=O)SCC(Nc2cc(c(cc2OC)[Cl])OC)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0711 |
| logD: | 1.1805 |
| logSw: | -4.4359 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.202 |
| InChI Key: | COMJEYHLJWIJPW-HSZRJFAPSA-N |