N-{[4-(methylsulfanyl)phenyl]methyl}-1-[4-(piperidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-1-[4-(piperidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
N-{[4-(methylsulfanyl)phenyl]methyl}-1-[4-(piperidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | P257-0646 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-1-[4-(piperidin-1-yl)pyrimidin-5-yl]piperidine-4-carboxamide |
| Molecular Weight: | 425.6 |
| Molecular Formula: | C23 H31 N5 O S |
| Smiles: | CSc1ccc(CNC(C2CCN(CC2)c2cncnc2N2CCCCC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5823 |
| logD: | 3.4957 |
| logSw: | -3.5088 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.469 |
| InChI Key: | LVZHBIYSIPGUDZ-UHFFFAOYSA-N |