N-(4-chlorophenyl)-5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
N-(4-chlorophenyl)-5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-7502 |
| Compound Name: | N-(4-chlorophenyl)-5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 533.05 |
| Molecular Formula: | C28 H25 Cl N4 O3 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccc(C)cc1C)=O)c1ccco1)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2747 |
| logD: | 4.4336 |
| logSw: | -5.8445 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.951 |
| InChI Key: | ASTWLQSXCZZTSP-SANMLTNESA-N |