(azepan-1-yl)[5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone
(azepan-1-yl)[5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone
Compound characteristics
| Compound ID: | J093-0436 |
| Compound Name: | (azepan-1-yl)[5-(4-methylphenyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]methanone |
| Molecular Weight: | 403.41 |
| Molecular Formula: | C20 H20 F3 N5 O |
| Smiles: | Cc1ccc(cc1)c1cc(C(F)(F)F)n2c(n1)nc(C(N1CCCCCC1)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.592 |
| logD: | 4.592 |
| logSw: | -4.3778 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.76 |
| InChI Key: | PRLBNRVBDCCCLO-UHFFFAOYSA-N |