methyl {4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(oxo)acetate
Chemical Structure Depiction of
methyl {4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(oxo)acetate
methyl {4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(oxo)acetate
Compound characteristics
| Compound ID: | V002-5262 |
| Compound Name: | methyl {4-[7-(2,5-dichlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]piperazin-1-yl}(oxo)acetate |
| Molecular Weight: | 435.27 |
| Molecular Formula: | C18 H16 Cl2 N6 O3 |
| Salt: | not_available |
| Smiles: | COC(C(N1CCN(CC1)c1nc2nccc(c3cc(ccc3[Cl])[Cl])n2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6528 |
| logD: | 2.6522 |
| logSw: | -3.4591 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.494 |
| InChI Key: | ZYQYUMNBJPKCFR-UHFFFAOYSA-N |