2-(3-methylphenoxy)-1-{4-[6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methylphenoxy)-1-{4-[6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
2-(3-methylphenoxy)-1-{4-[6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S471-0090 |
| Compound Name: | 2-(3-methylphenoxy)-1-{4-[6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 380.37 |
| Molecular Formula: | C18 H19 F3 N4 O2 |
| Smiles: | Cc1cccc(c1)OCC(N1CCN(CC1)c1cc(C(F)(F)F)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1854 |
| logD: | 3.1853 |
| logSw: | -3.0869 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.392 |
| InChI Key: | XYJGUCSMUJUOCN-UHFFFAOYSA-N |