AC1LQSI3 structure

AC1LQSI3

4-[[(1-benzyl-4-chloro-2,5-dioxopyrrol-3-yl)amino]methyl]-N-(3-methylphenyl)benzamide

Also Known As: 4-[[(1-benzyl-4-chloro-2,5-dioxopyrrol-3-yl)amino]methyl]-N-(3-methylphenyl)benzamide|4-[[(1-benzyl-4-chloro-2,5-dioxo-pyrrol-3-yl)amino]methyl]-N-(3-methylphenyl)benzamide|4-{[(1-Benzyl-4-chloro-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl)amino]methyl}-N-(3-methylphenyl)benzamide

CAS: 6846-47-5
Molecular Formula C26H22ClN3O3
Molecular Weight 459.13498 g/mol
LogP 4.35632
Topological Polar Surface Area 78.51 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 4
Rotatable Bonds 7
Exact Mass 459.13498
Monoisotopic Mass 459.13498
Heavy Atoms 33
Complexity 1237.1516

Chemical Identifiers

CAS Number 6846-47-5
SMILES CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CNC3=C(C(=O)N(C3=O)CC4=CC=CC=C4)Cl

Product Overview

AC1LQSI3 (CAS 6846-47-5), with molecular formula C26H22ClN3O3 and molecular weight 459.13498 g/mol. IUPAC: 4-[[(1-benzyl-4-chloro-2,5-dioxopyrrol-3-yl)amino]methyl]-N-(3-methylphenyl)benzamide.

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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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