6-[(2-anilino-2-oxoethyl)sulfanyl]-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
6-[(2-anilino-2-oxoethyl)sulfanyl]-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
6-[(2-anilino-2-oxoethyl)sulfanyl]-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8010-9994 |
| Compound Name: | 6-[(2-anilino-2-oxoethyl)sulfanyl]-5-cyano-N-(2-methoxyphenyl)-2-methyl-4-phenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 510.61 |
| Molecular Formula: | C29 H26 N4 O3 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccccc1)=O)c1ccccc1)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6792 |
| logD: | 3.965 |
| logSw: | -4.4836 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.004 |
| InChI Key: | JQJVFLKJFAUYJI-MHZLTWQESA-N |