5-methyl-6-[(4-methylphenyl)methyl]-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
5-methyl-6-[(4-methylphenyl)methyl]-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
5-methyl-6-[(4-methylphenyl)methyl]-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1496 |
| Compound Name: | 5-methyl-6-[(4-methylphenyl)methyl]-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 496.53 |
| Molecular Formula: | C26 H27 F3 N6 O |
| Smiles: | CC1=C(Cc2ccc(C)cc2)C(n2c(N1)nc(CN1CCN(CC1)c1cccc(c1)C(F)(F)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3233 |
| logD: | 2.9789 |
| logSw: | -4.2889 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.235 |
| InChI Key: | AXUQHOHJXUFGBU-UHFFFAOYSA-N |