[4-(adamantan-1-yl)piperazin-1-yl][5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
Chemical Structure Depiction of
[4-(adamantan-1-yl)piperazin-1-yl][5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
[4-(adamantan-1-yl)piperazin-1-yl][5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
Compound characteristics
| Compound ID: | 8013-3969 |
| Compound Name: | [4-(adamantan-1-yl)piperazin-1-yl][5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone |
| Molecular Weight: | 548.05 |
| Molecular Formula: | C28 H33 Cl F3 N5 O |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1CCN(CC1)C(c1cc2NC(CC(C(F)(F)F)n2n1)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.3061 |
| logD: | 6.2654 |
| logSw: | -6.6203 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.367 |
| InChI Key: | WDJNIEADSJLIEA-UHFFFAOYSA-N |