AC1NZDH4 structure

AC1NZDH4

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

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

CAS: 877802-66-9
Molecular Formula C29H28N2O7S
Molecular Weight 548.16174 g/mol
LogP 4.97662
Topological Polar Surface Area 115.26 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 7
Exact Mass 548.16174
Monoisotopic Mass 548.16174
Heavy Atoms 39
Complexity 1508.995

Chemical Identifiers

CAS Number 877802-66-9
SMILES CCCOC1=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

AC1NZDH4 (CAS 877802-66-9), with molecular formula C29H28N2O7S and molecular weight 548.16174 g/mol. IUPAC: methyl 2-[(4E)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-2,3-dioxo-5-(3-propoxyphenyl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.

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