2-[5,7-dimethyl-2-(3-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-(3-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-(3-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: | D458-0330 |
| Compound Name: | 2-[5,7-dimethyl-2-(3-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: | Cc1cccc(c1)c1nc2nc(C)c(CC(N3CCN(CC3)c3ccc(cc3)F)=O)c(C)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.0959 |
| logD: | 4.0959 |
| logSw: | -4.3495 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 50.486 |
| InChI Key: | PGDMTNSJKGEDHN-UHFFFAOYSA-N |