CAS 609796-52-3 - C31H34N2O7S
ethyl 2-[(4E)-4-[(4-butoxyphenyl)-hydroxymethylidene]-2,3-dioxo-5-(4-propoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Ethyl 2-(3-(4-butoxybenzoyl)-4-hydroxy-5-oxo-2-(4-propoxyphenyl)-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate
CAS: 609796-52-3
| Molecular Formula | C31H34N2O7S |
|---|---|
| Molecular Weight | 578.2087 g/mol |
| LogP | 6.22222 |
| Topological Polar Surface Area | 115.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 578.2087 |
| Monoisotopic Mass | 578.2087 |
| Heavy Atoms | 41 |
| Complexity | 1427.6481 |
Chemical Identifiers
| CAS Number | 609796-52-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OCC)C)C4=CC=C(C=C4)OCCC)/O |
Product Overview
CAS 609796-52-3 - C31H34N2O7S (CAS 609796-52-3), with molecular formula C31H34N2O7S and molecular weight 578.2087 g/mol. IUPAC: ethyl 2-[(4E)-4-[(4-butoxyphenyl)-hydroxymethylidene]-2,3-dioxo-5-(4-propoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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