2-{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
2-{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Compound characteristics
Compound ID: | 4552-4244 |
Compound Name: | 2-{[3-cyano-4-(4-methylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide |
Molecular Weight: | 407.49 |
Molecular Formula: | C22 H21 N3 O3 S |
Smiles: | Cc1ccc(cc1)C1CC(NC(=C1C#N)SCC(Nc1cccc(c1)OC)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3931 |
logD: | 3.3376 |
logSw: | -3.8075 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.609 |
InChI Key: | DVAYOEBNKFVIOB-GOSISDBHSA-N |