5-cyano-2-methyl-N,4-diphenyl-6-{[(pyridin-4-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-2-methyl-N,4-diphenyl-6-{[(pyridin-4-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
5-cyano-2-methyl-N,4-diphenyl-6-{[(pyridin-4-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | IB03-3433 |
| Compound Name: | 5-cyano-2-methyl-N,4-diphenyl-6-{[(pyridin-4-yl)methyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 438.55 |
| Molecular Formula: | C26 H22 N4 O S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCc1ccncc1)c1ccccc1)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7 |
| logD: | 3.15 |
| logSw: | -4.61 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 148.47 |
| InChI Key: | KIFWNTQLRVLOHA-DEOSSOPVSA-N |