AC1NQYXQ
1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione
Also Known As: 1-(4,6-Dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(3-ethoxyphenyl)(hydroxy)methylidene]pyrrolidine-2,3-dione|1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione
| Molecular Formula | C30H28N2O6S |
|---|---|
| Molecular Weight | 544.1668 g/mol |
| LogP | 6.04244 |
| Topological Polar Surface Area | 109.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 544.1668 |
| Monoisotopic Mass | 544.1668 |
| Heavy Atoms | 39 |
| Complexity | 1639.9703 |
Chemical Identifiers
| CAS Number | 7018-62-4 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(C=C(C=C4S3)C)C)C5=CC(=C(C=C5)O)OCC)O |
Product Overview
AC1NQYXQ (CAS 7018-62-4), with molecular formula C30H28N2O6S and molecular weight 544.1668 g/mol. IUPAC: 1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-hydroxyphenyl)-4-[(3-ethoxyphenyl)-hydroxymethylidene]pyrrolidine-2,3-dione.
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