1-[4-(3-methylphenyl)piperazin-1-yl]-4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butan-1-one
Chemical Structure Depiction of
1-[4-(3-methylphenyl)piperazin-1-yl]-4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butan-1-one
1-[4-(3-methylphenyl)piperazin-1-yl]-4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butan-1-one
Compound characteristics
| Compound ID: | D494-0685 |
| Compound Name: | 1-[4-(3-methylphenyl)piperazin-1-yl]-4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}butan-1-one |
| Molecular Weight: | 470.58 |
| Molecular Formula: | C26 H30 N8 O |
| Smiles: | Cc1cccc(c1)N1CCN(CC1)C(CCCNc1cc(C)nc2nc(c3cccnc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.426 |
| logD: | 2.2724 |
| logSw: | -2.4318 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.174 |
| InChI Key: | BPBDMULNHSULJM-UHFFFAOYSA-N |