ethyl 4-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate
ethyl 4-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate
Compound characteristics
Compound ID: | C130-0142 |
Compound Name: | ethyl 4-[4-(4-chlorophenyl)-6-(trifluoromethyl)pyrimidin-2-yl]piperazine-1-carboxylate |
Molecular Weight: | 414.81 |
Molecular Formula: | C18 H18 Cl F3 N4 O2 |
Smiles: | CCOC(N1CCN(CC1)c1nc(cc(C(F)(F)F)n1)c1ccc(cc1)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.4223 |
logD: | 5.4223 |
logSw: | -6.0094 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 43.698 |
InChI Key: | GRWSGIXWRWVUKL-UHFFFAOYSA-N |