AC1O2JL5 structure

AC1O2JL5

methyl 2-[(3E)-2-(3,4-diethoxyphenyl)-3-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate

Also Known As: methyl 2-(2-(3,4-diethoxyphenyl)-4-hydroxy-3-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate|methyl 2-[(3E)-2-(3,4-diethoxyphenyl)-3-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate|methyl 2-{(3E)-2-(3,4-diethoxyphenyl)-3-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl}-4-methyl-1,3-thiazole-5-carboxylate

CAS: 893701-25-2
Molecular Formula C30H30N2O8S
Molecular Weight 578.1723 g/mol
LogP 4.98522
Topological Polar Surface Area 124.49 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 10
Rotatable Bonds 8
Exact Mass 578.1723
Monoisotopic Mass 578.1723
Heavy Atoms 41
Complexity 1576.3624

Chemical Identifiers

CAS Number 893701-25-2
SMILES CCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC4=C(C=C3)OC(C4)C)\O)/C(=O)C(=O)N2C5=NC(=C(S5)C(=O)OC)C)OCC

Product Overview

AC1O2JL5 (CAS 893701-25-2), with molecular formula C30H30N2O8S and molecular weight 578.1723 g/mol. IUPAC: methyl 2-[(3E)-2-(3,4-diethoxyphenyl)-3-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.

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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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