(azepan-1-yl)[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
(azepan-1-yl)[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
Compound characteristics
| Compound ID: | 3209-1197 |
| Compound Name: | (azepan-1-yl)[3-chloro-5-(4-chlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone |
| Molecular Weight: | 461.31 |
| Molecular Formula: | C20 H21 Cl2 F3 N4 O |
| Smiles: | C1CCCN(CC1)C(c1c(c2NC(CC(C(F)(F)F)n2n1)c1ccc(cc1)[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.3186 |
| logD: | 5.3186 |
| logSw: | -6.0371 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.04 |
| InChI Key: | JHLGEGSPKXCOGV-UHFFFAOYSA-N |