[5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[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)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
[5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | K610-0326 |
| Compound Name: | [5-(2H-1,3-benzodioxol-5-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl][4-(3-chlorophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 533.94 |
| Molecular Formula: | C25 H23 Cl F3 N5 O3 |
| Smiles: | C1C(c2ccc3c(c2)OCO3)Nc2cc(C(N3CCN(CC3)c3cccc(c3)[Cl])=O)nn2C1C(F)(F)F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.9119 |
| logD: | 4.9119 |
| logSw: | -5.2318 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.79 |
| InChI Key: | VNSDSERKOHIZEB-UHFFFAOYSA-N |