ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-oxo-1lambda~5~-pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-oxo-1lambda~5~-pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-oxo-1lambda~5~-pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8017-9104 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1-oxo-1lambda~5~-pyridin-3-yl)-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 317.26 |
| Molecular Formula: | C12 H11 N7 O4 |
| Smiles: | CCOC(c1c(c2ccc[n+](c2)[O-])n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.454 |
| logD: | 0.454 |
| logSw: | -1.2071 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 123.048 |
| InChI Key: | FTSMPADAJKEAHS-UHFFFAOYSA-N |