1-(1H-indol-3-yl)-2-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethane-1,2-dione
Chemical Structure Depiction of
1-(1H-indol-3-yl)-2-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethane-1,2-dione
1-(1H-indol-3-yl)-2-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethane-1,2-dione
Compound characteristics
| Compound ID: | G866-0780 |
| Compound Name: | 1-(1H-indol-3-yl)-2-{4-[3-(4-methoxyphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}ethane-1,2-dione |
| Molecular Weight: | 482.5 |
| Molecular Formula: | C25 H22 N8 O3 |
| Smiles: | COc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)C(C(c2c[nH]c3ccccc23)=O)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 3.0616 |
| logD: | 3.0616 |
| logSw: | -3.4482 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.235 |
| InChI Key: | SOQKNEKBZWHPDL-UHFFFAOYSA-N |