AC1NZ78P structure

AC1NZ78P

methyl 2-[(3E)-2-(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-(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-(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-(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: 862199-89-1
Molecular Formula C28H26N2O7S
Molecular Weight 534.14606 g/mol
LogP 4.58652
Topological Polar Surface Area 115.26 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 6
Exact Mass 534.14606
Monoisotopic Mass 534.14606
Heavy Atoms 38
Complexity 1492.0577

Chemical Identifiers

CAS Number 862199-89-1
SMILES CCOC1=CC=CC(=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

Product Overview

AC1NZ78P (CAS 862199-89-1), with molecular formula C28H26N2O7S and molecular weight 534.14606 g/mol. IUPAC: methyl 2-[(3E)-2-(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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