N-{[4-(methylsulfanyl)phenyl]methyl}-1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-{[4-(methylsulfanyl)phenyl]methyl}-1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxamide
N-{[4-(methylsulfanyl)phenyl]methyl}-1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | S471-1228 |
| Compound Name: | N-{[4-(methylsulfanyl)phenyl]methyl}-1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidine-4-carboxamide |
| Molecular Weight: | 424.49 |
| Molecular Formula: | C20 H23 F3 N4 O S |
| Smiles: | Cc1nc(cc(n1)N1CCC(CC1)C(NCc1ccc(cc1)SC)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.0608 |
| logD: | 4.0608 |
| logSw: | -4.0401 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.752 |
| InChI Key: | CWTCGFVFGQQXPT-UHFFFAOYSA-N |