1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-[4-(propan-2-yl)phenoxy]ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-[4-(propan-2-yl)phenoxy]ethan-1-one
1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-[4-(propan-2-yl)phenoxy]ethan-1-one
Compound characteristics
| Compound ID: | G866-0759 |
| Compound Name: | 1-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}-2-[4-(propan-2-yl)phenoxy]ethan-1-one |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C26 H29 N7 O3 |
| Smiles: | CC(C)c1ccc(cc1)OCC(N1CCN(CC1)c1c2c(ncn1)n(c1ccc(cc1)OC)nn2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7371 |
| logD: | 3.7371 |
| logSw: | -3.9776 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.597 |
| InChI Key: | JPGOUUJQFYJLPG-UHFFFAOYSA-N |