ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluoroanilino)methyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluoroanilino)methyl]-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluoroanilino)methyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 6703-1744 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-fluoroanilino)methyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 347.31 |
| Molecular Formula: | C14 H14 F N7 O3 |
| Smiles: | CCOC(c1c(CNc2ccc(cc2)F)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8273 |
| logD: | 1.8273 |
| logSw: | -2.2422 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.827 |
| InChI Key: | KLXQSENKPWKREO-UHFFFAOYSA-N |