[rel-(5R,7S)-3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](2,6-dimethylpiperidin-1-yl)methanone
Chemical Structure Depiction of
[rel-(5R,7S)-3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](2,6-dimethylpiperidin-1-yl)methanone
[rel-(5R,7S)-3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](2,6-dimethylpiperidin-1-yl)methanone
Compound characteristics
| Compound ID: | 3209-0545 |
| Compound Name: | [rel-(5R,7S)-3-bromo-5-(thiophen-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl](2,6-dimethylpiperidin-1-yl)methanone |
| Molecular Weight: | 491.37 |
| Molecular Formula: | C19 H22 Br F3 N4 O S |
| Smiles: | CC1CCCC(C)N1C(c1c(c2N[C@H](C[C@@H](C(F)(F)F)n2n1)c1cccs1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3308 |
| logD: | 4.3308 |
| logSw: | -4.1881 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.951 |
| InChI Key: | MSPAROZJDWFINM-YZVRNYIASA-N |