ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-formyl-6-methoxyphenoxy)methyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-formyl-6-methoxyphenoxy)methyl]-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-formyl-6-methoxyphenoxy)methyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8013-3730 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(2-formyl-6-methoxyphenoxy)methyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 388.34 |
| Molecular Formula: | C16 H16 N6 O6 |
| Smiles: | CCOC(c1c(COc2c(C=O)cccc2OC)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3167 |
| logD: | 1.3167 |
| logSw: | -1.8839 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.783 |
| InChI Key: | YGYZKJBKDLRWNT-UHFFFAOYSA-N |