AC1LECTL
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-ethoxy-2-oxoethyl)triazole-4-carboxylate
Also Known As: Oprea1_253582|ZERO/001907|ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-ethoxy-2-oxoethyl)-1H-1,2,3-triazole-4-carboxylate|SR-01000399566-1|ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-ethoxy-2-oxoethyl)triazole-4-carboxylate|ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-ethoxy-2-oxoethyl)-1{H}-1,2,3-triazole-4-carboxylate|ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-ethoxy-2-oxo-ethyl)triazole-4-carboxylate|ethyl 2-[1-(4-amino(1,2,5-oxadiazol-3-yl))-4-(ethoxycarbonyl)-1,2,3-triazol-5- yl]acetate
| Molecular Formula | C11H14N6O5 |
|---|---|
| Molecular Weight | 310.10257 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 310.10257 |
| Monoisotopic Mass | 310.10257 |
| Heavy Atoms | 22 |
| Complexity | 410.0 |
Chemical Identifiers
| CAS Number | 313952-92-0 |
|---|---|
| SMILES | CCOC(=O)CC1=C(N=NN1C2=NON=C2N)C(=O)OCC |
| InChIKey | NGRJJIWYOZUVSW-UHFFFAOYSA-N |
Product Overview
AC1LECTL (CAS 313952-92-0), with molecular formula C11H14N6O5 and molecular weight 310.10257 g/mol. IUPAC: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-ethoxy-2-oxoethyl)triazole-4-carboxylate.
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