(azepan-1-yl)[5-(3,4-dichlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[5-(3,4-dichlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
(azepan-1-yl)[5-(3,4-dichlorophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl]methanone
Compound characteristics
| Compound ID: | 3209-1041 |
| Compound Name: | (azepan-1-yl)[5-(3,4-dichlorophenyl)-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(c1cc2NC(CC(C(F)(F)F)n2n1)c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.6954 |
| logD: | 5.6954 |
| logSw: | -6.1874 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.746 |
| InChI Key: | ZALCLGVEPQGHAO-UHFFFAOYSA-N |