4-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
4-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile
4-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | P664-0249 |
| Compound Name: | 4-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazine-1-carbonyl]benzonitrile |
| Molecular Weight: | 361.4 |
| Molecular Formula: | C19 H19 N7 O |
| Smiles: | Cc1cc(nc2nnc(C)n12)N1CCN(CC1)C(c1ccc(C#N)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1577 |
| logD: | 1.1566 |
| logSw: | -1.8521 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 68.742 |
| InChI Key: | QGXUXAZXLPHVOH-UHFFFAOYSA-N |