2-(4-ethoxyphenyl)-1-{4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-1-{4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
2-(4-ethoxyphenyl)-1-{4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G866-1009 |
| Compound Name: | 2-(4-ethoxyphenyl)-1-{4-[3-(4-ethoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C26 H29 N7 O3 |
| Smiles: | CCOc1ccc(CC(N2CCN(CC2)c2c3c(ncn2)n(c2ccc(cc2)OCC)nn3)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6526 |
| logD: | 3.6526 |
| logSw: | -3.5908 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.801 |
| InChI Key: | YRHYKWHMDPZTGD-UHFFFAOYSA-N |