5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | IB02-1880 |
| Compound Name: | 5-cyano-2-methyl-6-{[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl}-N,4-diphenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 572.69 |
| Molecular Formula: | C34 H28 N4 O3 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccc(cc1)Oc1ccccc1)=O)c1ccccc1)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.42 |
| logD: | 5.7 |
| logSw: | -6.92 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 172.42 |
| InChI Key: | MGTBUBWROCABFW-YTTGMZPUSA-N |