{4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone
{4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | G866-0170 |
| Compound Name: | {4-[3-(4-methylphenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]piperazin-1-yl}(phenyl)methanone |
| Molecular Weight: | 399.45 |
| Molecular Formula: | C22 H21 N7 O |
| Smiles: | Cc1ccc(cc1)n1c2c(c(ncn2)N2CCN(CC2)C(c2ccccc2)=O)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.9537 |
| logD: | 2.9537 |
| logSw: | -3.0079 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 67.081 |
| InChI Key: | VWKOSMLLSREOLK-UHFFFAOYSA-N |