AC1NY4JY structure

AC1NY4JY

3-[[2-methoxy-4-[(Z)-[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]phenoxy]methyl]benzoic acid

Also Known As: (Z)-3-[[4-[[2,5-Dioxo-1-[2-oxo-2-(p-tolylamino)ethyl]imidazolidin-4-ylidene]methyl]-2-methoxyphenoxy]methyl]benzoic Acid|3-({2-methoxy-4-[(1-{[N-(4-methylphenyl)carbamoyl]methyl}-2,5-dioxo(1,3-diazol idin-4-ylidene))methyl]phenoxy}methyl)benzoic acid|3-({2-methoxy-4-[(Z)-(1-{2-[(4-methylphenyl)amino]-2-oxoethyl}-2,5-dioxoimidazolidin-4-ylidene)methyl]phenoxy}methyl)benzoic acid|3-[[2-methoxy-4-[(Z)-[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]phenoxy]methyl]benzoic acid

CAS: 642000-26-8
Molecular Formula C28H25N3O7
Molecular Weight 515.16925 g/mol
LogP 3.81222
Topological Polar Surface Area 134.27 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 6
Rotatable Bonds 9
Exact Mass 515.16925
Monoisotopic Mass 515.16925
Heavy Atoms 38
Complexity 1430.6147

Chemical Identifiers

CAS Number 642000-26-8
SMILES CC1=CC=C(C=C1)NC(=O)CN2C(=O)/C(=C/C3=CC(=C(C=C3)OCC4=CC(=CC=C4)C(=O)O)OC)/NC2=O

Product Overview

AC1NY4JY (CAS 642000-26-8), with molecular formula C28H25N3O7 and molecular weight 515.16925 g/mol. IUPAC: 3-[[2-methoxy-4-[(Z)-[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]phenoxy]methyl]benzoic acid.

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