N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-7444 |
| Compound Name: | N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 543.09 |
| Molecular Formula: | C30 H27 Cl N4 O2 S |
| Smiles: | CCc1ccc(cc1)NC(CSC1=C(C#N)C(C(=C(C)N1)C(Nc1ccc(cc1)[Cl])=O)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.445 |
| logD: | 5.7308 |
| logSw: | -6.372 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.071 |
| InChI Key: | JVJQOBZIHWNMSI-MUUNZHRXSA-N |