RefChem:813196
methyl 2-[(3E)-2-(4-butoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Methyl 2-(2-(4-butoxyphenyl)-3-(3-fluoro-4-methylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate|637-801-5|METHYL 2-(2-(4-BUTOXYPHENYL)-3-(3-FLUORO-4-METHYLBENZOYL)-4-HYDROXY-5-OXO-2,5-D IHYDRO-1H-PYRROL-1-YL)-4-METHYL-1,3-THIAZOLE-5-CARBOXYLATE|Methyl 2-[2-(4-butoxyphenyl)-3-(3-fluoro-4-methylbenzoyl)-4-hydroxy-5-oxo-2,5-D ihydro-1H-pyrrol-1-YL]-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C28H27FN2O6S |
|---|---|
| Molecular Weight | 538.1574 g/mol |
| LogP | 5.49084 |
| Topological Polar Surface Area | 106.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 538.1574 |
| Monoisotopic Mass | 538.1574 |
| Heavy Atoms | 38 |
| Complexity | 1429.5956 |
Chemical Identifiers
| CAS Number | 618072-64-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)C2/C(=C(/C3=CC(=C(C=C3)C)F)\O)/C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OC)C |
Product Overview
RefChem:813196 (CAS 618072-64-3), with molecular formula C28H27FN2O6S and molecular weight 538.1574 g/mol. IUPAC: methyl 2-[(3E)-2-(4-butoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
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