ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[2-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[2-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[2-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8008-7318 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[2-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 401.38 |
| Molecular Formula: | C17 H19 N7 O5 |
| Smiles: | CCOC(c1ccccc1NCc1c(C(=O)OCC)nnn1c1c(N)non1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4027 |
| logD: | 2.4027 |
| logSw: | -2.798 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 133.883 |
| InChI Key: | HRTHPTWCEDUDLJ-UHFFFAOYSA-N |