7-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | J043-0003 |
| Compound Name: | 7-(4-chlorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 276.68 |
| Molecular Formula: | C12 H9 Cl N4 O2 |
| Smiles: | C1C(c2ccc(cc2)[Cl])n2c(NC=1C(O)=O)ncn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8484 |
| logD: | -1.7907 |
| logSw: | -2.8775 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.28 |
| InChI Key: | AEPBKVYSXOTJJL-JTQLQIEISA-N |