1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(pyrrolidin-1-yl)methyl]-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(pyrrolidin-1-yl)methyl]-1H-1,2,3-triazole-4-carboxylic acid
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(pyrrolidin-1-yl)methyl]-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
Compound ID: | 6703-0632 |
Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(pyrrolidin-1-yl)methyl]-1H-1,2,3-triazole-4-carboxylic acid |
Molecular Weight: | 279.26 |
Molecular Formula: | C10 H13 N7 O3 |
Smiles: | C1CCN(C1)Cc1c(C(O)=O)nnn1c1c(N)non1 |
Stereo: | ACHIRAL |
logP: | -0.5482 |
logD: | -0.5482 |
logSw: | 0.4038 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 115.346 |
InChI Key: | PJPZKZPMZWJYAO-UHFFFAOYSA-N |