5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide
5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4296-0618 |
| Compound Name: | 5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-N-(2-methoxyphenyl)-2-methyl-4-(5-methylfuran-2-yl)-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 542.66 |
| Molecular Formula: | C30 H30 N4 O4 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccc(C)cc1C)=O)c1ccc(C)o1)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1606 |
| logD: | 4.3196 |
| logSw: | -4.881 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.398 |
| InChI Key: | LWSHJRKHPCBBKO-MUUNZHRXSA-N |