{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}[2-(trifluoromethoxy)phenyl]methanone
Chemical Structure Depiction of
{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}[2-(trifluoromethoxy)phenyl]methanone
{4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}[2-(trifluoromethoxy)phenyl]methanone
Compound characteristics
| Compound ID: | V006-7583 |
| Compound Name: | {4-[4-(2H-1,3-benzodioxol-5-yl)pyrimidin-2-yl]piperazin-1-yl}[2-(trifluoromethoxy)phenyl]methanone |
| Molecular Weight: | 472.42 |
| Molecular Formula: | C23 H19 F3 N4 O4 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1C(c1ccccc1OC(F)(F)F)=O)c1nccc(c2ccc3c(c2)OCO3)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7835 |
| logD: | 4.7828 |
| logSw: | -4.8062 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.945 |
| InChI Key: | MJEGVKXFYVWSIL-UHFFFAOYSA-N |