1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylic acid
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8008-6999 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 272.22 |
| Molecular Formula: | C11 H8 N6 O3 |
| Smiles: | c1ccc(cc1)c1c(C(O)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 0.7061 |
| logD: | -4.755 |
| logSw: | -1.2432 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 110.495 |
| InChI Key: | KHLKPBNYKKVIAM-UHFFFAOYSA-N |