ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8005-2737 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-phenyl-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C13 H12 N6 O3 |
| Smiles: | CCOC(c1c(c2ccccc2)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7907 |
| logD: | 1.7907 |
| logSw: | -2.005 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.84 |
| InChI Key: | XZSMHRAGXUUTQP-UHFFFAOYSA-N |