4-(4-chlorophenyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine-5-carbonitrile
4-(4-chlorophenyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D287-0148 |
| Compound Name: | 4-(4-chlorophenyl)-2-(methylsulfanyl)-6-(piperidin-1-yl)pyrimidine-5-carbonitrile |
| Molecular Weight: | 344.86 |
| Molecular Formula: | C17 H17 Cl N4 S |
| Smiles: | CSc1nc(c2ccc(cc2)[Cl])c(C#N)c(n1)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.0322 |
| logD: | 5.0322 |
| logSw: | -5.5063 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 38.472 |
| InChI Key: | QKGXNTNWCITKJZ-UHFFFAOYSA-N |