2-{[5-acetyl-4-(2-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Chemical Structure Depiction of
2-{[5-acetyl-4-(2-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide
2-{[5-acetyl-4-(2-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide
Compound characteristics
| Compound ID: | 8009-1216 |
| Compound Name: | 2-{[5-acetyl-4-(2-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-(4-bromophenyl)acetamide |
| Molecular Weight: | 516.84 |
| Molecular Formula: | C23 H19 Br Cl N3 O2 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1ccc(cc1)[Br])=O)c1ccccc1[Cl])C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2791 |
| logD: | 3.2125 |
| logSw: | -5.7305 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.806 |
| InChI Key: | VIQFLTCPGKAGHE-QFIPXVFZSA-N |