ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(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-{[4-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8008-3939 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(ethoxycarbonyl)anilino]methyl}-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 401.38 |
| Molecular Formula: | C17 H19 N7 O5 |
| Smiles: | CCOC(c1ccc(cc1)NCc1c(C(=O)OCC)nnn1c1c(N)non1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3996 |
| logD: | 2.3996 |
| logSw: | -2.6627 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 134.581 |
| InChI Key: | VZALHWFVGPEZET-UHFFFAOYSA-N |