7-(2-butoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-(2-butoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
7-(2-butoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
Compound ID: | C276-1719 |
Compound Name: | 7-(2-butoxyphenyl)-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: | CCCCOc1ccccc1C1C=C(C(O)=O)Nc2ncnn12 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.9081 |
logD: | -0.7311 |
logSw: | -3.2673 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.784 |
InChI Key: | RISIHKKZWLXCEN-CYBMUJFWSA-N |