AC1LZG6S
2-O-tert-butyl 4-O-ethyl 5-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: 2-tert-butyl 4-ethyl 5-({(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)-3-methylthiophene-2,4-dicarboxylate|(Z)-2-tert-butyl 4-ethyl 5-((2-(4-(benzo[d][1,3]dioxol-5-yl)thiazol-2-yl)-2-cyanovinyl)amino)-3-methylthiophene-2,4-dicarboxylate|2-O-tert-butyl 4-O-ethyl 5-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C26H25N3O6S2 |
|---|---|
| Molecular Weight | 539.11847 g/mol |
| LogP | 6.0173 |
| Topological Polar Surface Area | 119.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 539.11847 |
| Monoisotopic Mass | 539.11847 |
| Heavy Atoms | 37 |
| Complexity | 1424.8888 |
Chemical Identifiers
| CAS Number | 577982-50-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)(C)C)N/C=C(/C#N)\C2=NC(=CS2)C3=CC4=C(C=C3)OCO4 |
Product Overview
AC1LZG6S (CAS 577982-50-4), with molecular formula C26H25N3O6S2 and molecular weight 539.11847 g/mol. IUPAC: 2-O-tert-butyl 4-O-ethyl 5-[[(Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]-3-methylthiophene-2,4-dicarboxylate.