5-methyl-6-{[4-(propan-2-yl)phenyl]methyl}-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-6-{[4-(propan-2-yl)phenyl]methyl}-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-6-{[4-(propan-2-yl)phenyl]methyl}-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 8561-08415 |
| Compound Name: | 5-methyl-6-{[4-(propan-2-yl)phenyl]methyl}-2-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 350.34 |
| Molecular Formula: | C17 H17 F3 N4 O |
| Smiles: | CC(C)c1ccc(CC2=C(C)Nc3nc(C(F)(F)F)nn3C2=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1915 |
| logD: | 0.7844 |
| logSw: | -4.2319 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.251 |
| InChI Key: | HSWDPZZGBJJEMY-UHFFFAOYSA-N |