2-(2-chloro-4-methoxyphenyl)-1-[4-(3,5-dimethyl[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-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one
2-(2-chloro-4-methoxyphenyl)-1-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | P664-0310 |
| Compound Name: | 2-(2-chloro-4-methoxyphenyl)-1-[4-(3,5-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-7-yl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C20 H23 Cl N6 O2 |
| Smiles: | Cc1cc(nc2nnc(C)n12)N1CCN(CC1)C(Cc1ccc(cc1[Cl])OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6908 |
| logD: | 2.6898 |
| logSw: | -3.3134 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 58.702 |
| InChI Key: | VRJLRLSIZZSYOB-UHFFFAOYSA-N |