N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | M179-4321 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-{[6-(2-methylpiperidin-1-yl)pyrimidin-4-yl]sulfanyl}acetamide |
| Molecular Weight: | 444.9 |
| Molecular Formula: | C19 H20 Cl F3 N4 O S |
| Smiles: | CC1CCCCN1c1cc(ncn1)SCC(Nc1cc(ccc1[Cl])C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0587 |
| logD: | 5.0217 |
| logSw: | -5.3805 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.79 |
| InChI Key: | YLQQLKCYPHTRSY-LBPRGKRZSA-N |