AC1O2KS1 structure

AC1O2KS1

methyl 2-[(3E)-2-(4-butoxy-3-ethoxyphenyl)-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-(4-butoxy-3-ethoxyphenyl)-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-(4-butoxy-3-ethoxyphenyl)-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-(4-butoxy-3-ethoxyphenyl)-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: 893701-17-2
Molecular Formula C32H34N2O8S
Molecular Weight 606.2036 g/mol
LogP 5.76542
Topological Polar Surface Area 124.49 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 10
Rotatable Bonds 10
Exact Mass 606.2036
Monoisotopic Mass 606.2036
Heavy Atoms 43
Complexity 1610.5219

Chemical Identifiers

CAS Number 893701-17-2
SMILES CCCCOC1=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

AC1O2KS1 (CAS 893701-17-2), with molecular formula C32H34N2O8S and molecular weight 606.2036 g/mol. IUPAC: methyl 2-[(3E)-2-(4-butoxy-3-ethoxyphenyl)-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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