5-acetyl-4-(4-chlorophenyl)-2-(ethylsulfanyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile
Chemical Structure Depiction of
5-acetyl-4-(4-chlorophenyl)-2-(ethylsulfanyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile
5-acetyl-4-(4-chlorophenyl)-2-(ethylsulfanyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4088-0327 |
| Compound Name: | 5-acetyl-4-(4-chlorophenyl)-2-(ethylsulfanyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile |
| Molecular Weight: | 332.85 |
| Molecular Formula: | C17 H17 Cl N2 O S |
| Smiles: | CCSC1=C(C#N)C(C(=C(C)N1)C(C)=O)c1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7894 |
| logD: | 1.5454 |
| logSw: | -4.748 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.929 |
| InChI Key: | PAYBIHXAGZQYSL-MRXNPFEDSA-N |