N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide
Compound characteristics
Compound ID: | 4554-6357 |
Compound Name: | N-(3-chloro-4-methylphenyl)-2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetamide |
Molecular Weight: | 455.96 |
Molecular Formula: | C23 H22 Cl N3 O3 S |
Smiles: | CCOc1ccc(cc1)C1CC(NC(=C1C#N)SCC(Nc1ccc(C)c(c1)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.6624 |
logD: | 4.6069 |
logSw: | -4.9267 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.188 |
InChI Key: | MPKKSJPOKVDNLY-GOSISDBHSA-N |