2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Compound characteristics
Compound ID: | 4554-6347 |
Compound Name: | 2-{[3-cyano-4-(4-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(4-methylphenyl)acetamide |
Molecular Weight: | 421.52 |
Molecular Formula: | C23 H23 N3 O3 S |
Smiles: | CCOc1ccc(cc1)C1CC(NC(=C1C#N)SCC(Nc1ccc(C)cc1)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.6956 |
logD: | 3.6401 |
logSw: | -3.7699 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.188 |
InChI Key: | PTMHENNPZPCKBP-LJQANCHMSA-N |