7-{2-[(butan-2-yl)oxy]phenyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-{2-[(butan-2-yl)oxy]phenyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
7-{2-[(butan-2-yl)oxy]phenyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | C276-1733 |
| Compound Name: | 7-{2-[(butan-2-yl)oxy]phenyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C16 H18 N4 O3 |
| Smiles: | CCC(C)Oc1ccccc1C1C=C(C(O)=O)Nc2ncnn12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6695 |
| logD: | -0.9697 |
| logSw: | -3.0447 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.052 |
| InChI Key: | WEVYQNOECMTEGQ-UHFFFAOYSA-N |