(azepan-1-yl)[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
(azepan-1-yl)[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
Compound characteristics
| Compound ID: | Y508-7161 |
| Compound Name: | (azepan-1-yl)[5-(4-bromophenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone |
| Molecular Weight: | 471.32 |
| Molecular Formula: | C20 H22 Br F3 N4 O |
| Smiles: | C1CCCN(CC1)C(c1cnn2C(CC(c3ccc(cc3)[Br])Nc12)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.9193 |
| logD: | 4.9193 |
| logSw: | -4.5459 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.493 |
| InChI Key: | GEOHILAKVDXPEQ-UHFFFAOYSA-N |