(3,4-dihydroisoquinolin-2(1H)-yl)[rel-(5R,7S)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
Chemical Structure Depiction of
(3,4-dihydroisoquinolin-2(1H)-yl)[rel-(5R,7S)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
(3,4-dihydroisoquinolin-2(1H)-yl)[rel-(5R,7S)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone
Compound characteristics
| Compound ID: | 7213-0124 |
| Compound Name: | (3,4-dihydroisoquinolin-2(1H)-yl)[rel-(5R,7S)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-3-yl]methanone |
| Molecular Weight: | 456.47 |
| Molecular Formula: | C24 H23 F3 N4 O2 |
| Smiles: | COc1cccc(c1)[C@H]1C[C@@H](C(F)(F)F)n2c(c(cn2)C(N2CCc3ccccc3C2)=O)N1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3915 |
| logD: | 4.3915 |
| logSw: | -4.1886 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.368 |
| InChI Key: | BRYOSWHIRRCJHL-NHCUHLMSSA-N |