2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)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-(2,4,6-trimethylphenyl)acetamide
2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Compound characteristics
Compound ID: | 4296-0891 |
Compound Name: | 2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide |
Molecular Weight: | 447.56 |
Molecular Formula: | C25 H25 N3 O3 S |
Smiles: | Cc1cc(C)c(c(C)c1)NC(CSC1=C(C#N)C(C2=C(CCCC2=O)N1)c1ccco1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7661 |
logD: | 0.8756 |
logSw: | -3.8431 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.73 |
InChI Key: | FGUWWCDYWPBIIP-JOCHJYFZSA-N |