7-(3-chloro-4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(3-chloro-4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(3-chloro-4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
Compound ID: | C276-1687 |
Compound Name: | 7-(3-chloro-4-methoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid |
Molecular Weight: | 306.71 |
Molecular Formula: | C13 H11 Cl N4 O3 |
Smiles: | COc1ccc(cc1[Cl])C1C=C(C(O)=O)Nc2ncnn12 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7199 |
logD: | -1.9192 |
logSw: | -2.6478 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.91 |
InChI Key: | WULAOJJCOXOFHW-JTQLQIEISA-N |