2-({4-[4-(benzyloxy)phenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
Chemical Structure Depiction of
2-({4-[4-(benzyloxy)phenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
2-({4-[4-(benzyloxy)phenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide
Compound characteristics
| Compound ID: | 5542-0197 |
| Compound Name: | 2-({4-[4-(benzyloxy)phenyl]-3-cyano-6-oxo-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)-N-(3-chloro-2-methylphenyl)acetamide |
| Molecular Weight: | 518.03 |
| Molecular Formula: | C28 H24 Cl N3 O3 S |
| Smiles: | Cc1c(cccc1[Cl])NC(CSC1=C(C#N)C(CC(N1)=O)c1ccc(cc1)OCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1249 |
| logD: | 5.0694 |
| logSw: | -5.611 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.595 |
| InChI Key: | ZTWNMUBXFFALHM-JOCHJYFZSA-N |