7-(2H-1,3-benzodioxol-5-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(2H-1,3-benzodioxol-5-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(2H-1,3-benzodioxol-5-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | C276-1691 |
| Compound Name: | 7-(2H-1,3-benzodioxol-5-yl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 286.24 |
| Molecular Formula: | C13 H10 N4 O4 |
| Smiles: | C1Oc2ccc(cc2O1)C1C=C(C(O)=O)Nc2ncnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1771 |
| logD: | -2.4621 |
| logSw: | -2.0084 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.395 |
| InChI Key: | VSRVPWZEONYJEP-SECBINFHSA-N |