2-[5,7-dimethyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[5,7-dimethyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
2-[5,7-dimethyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | D458-0276 |
| Compound Name: | 2-[5,7-dimethyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-[4-(4-fluorophenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 458.54 |
| Molecular Formula: | C26 H27 F N6 O |
| Smiles: | Cc1ccccc1c1nc2nc(C)c(CC(N3CCN(CC3)c3ccc(cc3)F)=O)c(C)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.81 |
| logD: | 3.8099 |
| logSw: | -4.1578 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.486 |
| InChI Key: | XHFGPYFXGLJKJT-UHFFFAOYSA-N |