AC1NYJP6
ethyl 2-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Oprea1_695432|ethyl 2-(2-(2-fluorophenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate|ethyl 2-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate|ethyl 2-{(3E)-2-(2-fluorophenyl)-3-[hydroxy(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate|ethyl 2-{2-(2-fluorophenyl)-4-hydroxy-3-[(4-methoxyphenyl)carbonyl]-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}-4-methyl-1,3-thiazole-5-carboxylate|ethyl 2-{5-(2-fluorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-2-oxo(3-py rrolinyl)}-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C25H21FN2O6S |
|---|---|
| Molecular Weight | 496.11044 g/mol |
| LogP | 4.40222 |
| Topological Polar Surface Area | 106.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 496.11044 |
| Monoisotopic Mass | 496.11044 |
| Heavy Atoms | 35 |
| Complexity | 1348.2418 |
Chemical Identifiers
| CAS Number | 384374-29-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)N2C(/C(=C(/C3=CC=C(C=C3)OC)\O)/C(=O)C2=O)C4=CC=CC=C4F)C |
Product Overview
AC1NYJP6 (CAS 384374-29-2), with molecular formula C25H21FN2O6S and molecular weight 496.11044 g/mol. IUPAC: ethyl 2-[(3E)-2-(2-fluorophenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
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