AC1NZ1MY
(2E)-5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
Also Known As: A1284/0058587|(2E)-5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile|(E)-5-amino-2-(3-ethoxy-4-hydroxybenzylidene)-7-(3-ethoxy-4-hydroxyphenyl)-3-oxo-3,7-dihydro-2H-thiazolo[3,2-a]pyridine-6,8-dicarbonitrile
| Molecular Formula | C26H22N4O5S |
|---|---|
| Molecular Weight | 502.1311 g/mol |
| LogP | 2.06976 |
| Topological Polar Surface Area | 154.52 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 502.1311 |
| Monoisotopic Mass | 502.1311 |
| Heavy Atoms | 36 |
| Complexity | 1653.079 |
Chemical Identifiers
| CAS Number | 313381-68-9 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C/2\C(=O)N3C(=C(C(C(=C3S2)C#N)C4=CC(=C(C=C4)O)OCC)C#N)N)O |
Product Overview
AC1NZ1MY (CAS 313381-68-9), with molecular formula C26H22N4O5S and molecular weight 502.1311 g/mol. IUPAC: (2E)-5-amino-7-(3-ethoxy-4-hydroxyphenyl)-2-[(3-ethoxy-4-hydroxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarbonitrile.
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