2-(methylsulfanyl)-4-phenyl-N-[3-(piperidin-1-yl)propyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
2-(methylsulfanyl)-4-phenyl-N-[3-(piperidin-1-yl)propyl]pyrimidine-5-carboxamide
2-(methylsulfanyl)-4-phenyl-N-[3-(piperidin-1-yl)propyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0495 |
| Compound Name: | 2-(methylsulfanyl)-4-phenyl-N-[3-(piperidin-1-yl)propyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 370.52 |
| Molecular Formula: | C20 H26 N4 O S |
| Smiles: | CSc1ncc(C(NCCCN2CCCCC2)=O)c(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.1647 |
| logD: | 0.5685 |
| logSw: | -3.3787 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.79 |
| InChI Key: | XTCLBUDQUUNJGC-UHFFFAOYSA-N |