[4-methyl-2-(methylsulfanyl)pyrimidin-5-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
[4-methyl-2-(methylsulfanyl)pyrimidin-5-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
[4-methyl-2-(methylsulfanyl)pyrimidin-5-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | E727-0291 |
| Compound Name: | [4-methyl-2-(methylsulfanyl)pyrimidin-5-yl]{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 396.43 |
| Molecular Formula: | C18 H19 F3 N4 O S |
| Smiles: | Cc1c(cnc(n1)SC)C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2837 |
| logD: | 3.2837 |
| logSw: | -3.4304 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.539 |
| InChI Key: | BOXADPDHSNJPFU-UHFFFAOYSA-N |