4-[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
4-[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile
4-[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | P664-0074 |
| Compound Name: | 4-[4-(5-methyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile |
| Molecular Weight: | 347.38 |
| Molecular Formula: | C18 H17 N7 O |
| Smiles: | Cc1cc(nc2nncn12)N1CCN(CC1)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0473 |
| logD: | 1.0471 |
| logSw: | -1.8287 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 68.571 |
| InChI Key: | DAKOLEIIGRLGBT-UHFFFAOYSA-N |