N-(3-chloro-2-methylphenyl)-2-({3-cyano-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-2-({3-cyano-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)acetamide
N-(3-chloro-2-methylphenyl)-2-({3-cyano-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 4296-0764 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-2-({3-cyano-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinolin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 531.98 |
| Molecular Formula: | C26 H21 Cl F3 N3 O2 S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c1ccccc1C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8005 |
| logD: | 3.0622 |
| logSw: | -5.7473 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.849 |
| InChI Key: | OJYNXWQQHRXJEQ-QHCPKHFHSA-N |