ethyl 1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-3-carboxylate
ethyl 1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-3-carboxylate
Compound characteristics
| Compound ID: | D490-0352 |
| Compound Name: | ethyl 1-[6-(4-chlorophenyl)-5-cyano-2-(methylsulfanyl)pyrimidin-4-yl]piperidine-3-carboxylate |
| Molecular Weight: | 416.93 |
| Molecular Formula: | C20 H21 Cl N4 O2 S |
| Smiles: | CCOC(C1CCCN(C1)c1c(C#N)c(c2ccc(cc2)[Cl])nc(n1)SC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7358 |
| logD: | 4.7358 |
| logSw: | -5.13 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.159 |
| InChI Key: | SQJAJWYCYCWSKR-AWEZNQCLSA-N |