2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | D433-1495 |
| Compound Name: | 2-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-5-methyl-6-[(4-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 446.53 |
| Molecular Formula: | C25 H27 F N6 O |
| Smiles: | CC1=C(Cc2ccc(C)cc2)C(n2c(N1)nc(CN1CCN(CC1)c1ccc(cc1)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6732 |
| logD: | 2.3288 |
| logSw: | -3.708 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.235 |
| InChI Key: | VFRQEINDOUTWOG-UHFFFAOYSA-N |