1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[ethyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[ethyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carboxylic acid
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[ethyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8538-0131 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[ethyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 329.32 |
| Molecular Formula: | C14 H15 N7 O3 |
| Smiles: | CCN(Cc1c(C(O)=O)nnn1c1c(N)non1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.1868 |
| logD: | -4.8313 |
| logSw: | -2.0234 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.987 |
| InChI Key: | DAZHKAHDMGTHEW-UHFFFAOYSA-N |