[5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
[5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
[5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | A0012913 |
| Compound Name: | [5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 529.91 |
| Molecular Formula: | C25 H19 Cl F3 N5 O3 |
| Smiles: | C1CN(CCN1C(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc2c(c1)OCO2)=O)c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2865 |
| logD: | 5.2848 |
| logSw: | -6.015 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.422 |
| InChI Key: | KFOMEPLRIVILTK-UHFFFAOYSA-N |