CAS 617697-33-3 - C28H25FN2O7S
prop-2-enyl 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Allyl 2-(2-(3,4-dimethoxyphenyl)-3-(3-fluoro-4-methylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate
CAS: 617697-33-3
| Molecular Formula | C28H25FN2O7S |
|---|---|
| Molecular Weight | 552.13666 g/mol |
| LogP | 4.88534 |
| Topological Polar Surface Area | 115.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 552.13666 |
| Monoisotopic Mass | 552.13666 |
| Heavy Atoms | 39 |
| Complexity | 1528.0446 |
Chemical Identifiers
| CAS Number | 617697-33-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC=C)C)C4=CC(=C(C=C4)OC)OC)/O)F |
Product Overview
CAS 617697-33-3 - C28H25FN2O7S (CAS 617697-33-3), with molecular formula C28H25FN2O7S and molecular weight 552.13666 g/mol. IUPAC: prop-2-enyl 2-[(3E)-2-(3,4-dimethoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Safety Data Sheet (MSDS / SDS)
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