1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-methylbutan-1-one
Chemical Structure Depiction of
1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-methylbutan-1-one
1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-methylbutan-1-one
Compound characteristics
| Compound ID: | V006-4913 |
| Compound Name: | 1-{4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}-2-methylbutan-1-one |
| Molecular Weight: | 433.34 |
| Molecular Formula: | C20 H22 Cl2 N6 O |
| Smiles: | CCC(C)C(N1CCN(CC1)c1nc2nccc(c3cc(ccc3[Cl])[Cl])n2n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1497 |
| logD: | 4.1473 |
| logSw: | -4.4339 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.32 |
| InChI Key: | ZHTCNLPZXJKUSR-ZDUSSCGKSA-N |