2-(2-chloro-4-methoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(2-chloro-4-methoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
2-(2-chloro-4-methoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | P664-1334 |
| Compound Name: | 2-(2-chloro-4-methoxyphenyl)-1-{4-[5-(propan-2-yl)[1,2,4]triazolo[4,3-a]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 428.92 |
| Molecular Formula: | C21 H25 Cl N6 O2 |
| Smiles: | CC(C)c1cc(nc2nncn12)N1CCN(CC1)C(Cc1ccc(cc1[Cl])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5638 |
| logD: | 3.5638 |
| logSw: | -3.7404 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.56 |
| InChI Key: | ZSKVRCLTRYVAGL-UHFFFAOYSA-N |