N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-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-(4-ethylanilino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4296-0163 |
| Compound Name: | N-(4-chlorophenyl)-5-cyano-6-{[2-(4-ethylanilino)-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: | CCc1ccc(cc1)NC(CSC1=C(C#N)C(C(=C(C)N1)C(Nc1ccc(cc1)[Cl])=O)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7227 |
| logD: | 4.8816 |
| logSw: | -5.9059 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.649 |
| InChI Key: | CBFMMEVREQRHEJ-SANMLTNESA-N |