{4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone
{4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | D573-0099 |
| Compound Name: | {4-[6-methyl-2-(pyrrolidin-1-yl)pyrimidin-4-yl]piperazin-1-yl}[4-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 419.45 |
| Molecular Formula: | C21 H24 F3 N5 O |
| Smiles: | Cc1cc(nc(n1)N1CCCC1)N1CCN(CC1)C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4127 |
| logD: | 4.401 |
| logSw: | -4.2787 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.734 |
| InChI Key: | OETOTCBNLXUJGE-UHFFFAOYSA-N |