7-(2H-1,3-benzodioxol-5-yl)-2-(pyridin-4-yl)[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(2H-1,3-benzodioxol-5-yl)-2-(pyridin-4-yl)[1,2,4]triazolo[1,5-a]pyrimidine
7-(2H-1,3-benzodioxol-5-yl)-2-(pyridin-4-yl)[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | Y020-4482 |
| Compound Name: | 7-(2H-1,3-benzodioxol-5-yl)-2-(pyridin-4-yl)[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 317.3 |
| Molecular Formula: | C17 H11 N5 O2 |
| Smiles: | C1Oc2ccc(cc2O1)c1ccnc2nc(c3ccncc3)nn12 |
| Stereo: | ACHIRAL |
| logP: | 2.4204 |
| logD: | 2.4203 |
| logSw: | -2.3634 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.485 |
| InChI Key: | NIMFAKKYJJMCCQ-UHFFFAOYSA-N |