1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | D490-0355 |
| Compound Name: | 1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 387.89 |
| Molecular Formula: | C18 H18 Cl N5 O S |
| Smiles: | CSc1nc(c2ccc(cc2)[Cl])c(C#N)c(n1)N1CCC(CC1)C(N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4119 |
| logD: | 3.4119 |
| logSw: | -4.3684 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.531 |
| InChI Key: | ZSVRMHPNOIOKRH-UHFFFAOYSA-N |