5-cyano-6-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-6-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
5-cyano-6-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-7507 |
| Compound Name: | 5-cyano-6-{[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C30 H28 N4 O2 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1cccc(C)c1C)=O)c1ccccc1)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3584 |
| logD: | 4.6442 |
| logSw: | -5.3731 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.373 |
| InChI Key: | VMEZPXRMJFTTDV-NDEPHWFRSA-N |