{4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
{4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | D430-0563 |
| Compound Name: | {4-[2-methyl-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C22 H27 F3 N6 O |
| Smiles: | Cc1nc(cc(n1)N1CCN(CC1)C(c1cccc(c1)C(F)(F)F)=O)N1CCN(C)CC1 |
| Stereo: | ACHIRAL |
| logP: | 3.3435 |
| logD: | 2.7735 |
| logSw: | -3.5201 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 44.187 |
| InChI Key: | AURKLDBCDAPYMX-UHFFFAOYSA-N |