2-{[3-cyano-4-(4-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
Chemical Structure Depiction of
2-{[3-cyano-4-(4-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
2-{[3-cyano-4-(4-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide
Compound characteristics
| Compound ID: | 8011-7382 |
| Compound Name: | 2-{[3-cyano-4-(4-methoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(3,5-dichlorophenyl)acetamide |
| Molecular Weight: | 462.35 |
| Molecular Formula: | C21 H17 Cl2 N3 O3 S |
| Smiles: | COc1ccc(cc1)C1CC(NC(=C1C#N)SCC(Nc1cc(cc(c1)[Cl])[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4161 |
| logD: | 4.3606 |
| logSw: | -4.7947 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.609 |
| InChI Key: | SCPIFIRDAUNNGN-QGZVFWFLSA-N |