AC1NDN3N structure

AC1NDN3N

2-(2-methylphenyl)-N-[3-[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]-4-phenyldiazenylphenyl]quinoline-4-carboxamide

Also Known As: 4-Quinolinecarboxamide, N,N'-[4-(phenylazo)-1,3-phenylene]bis[2-(2-methylphenyl)- (9CI)|4-Quinolinecarboxamide, N,N'-[4-(phenylazo)-1,3-phenylene]bis[2-(2-methylphenyl)-(9CI)|2-(2-methylphenyl)-N-[3-[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]-4-phenyldiazenylphenyl]quinoline-4-carboxamide

CAS: 548468-97-9
Molecular Formula C46H34N6O2
Molecular Weight 702.27435 g/mol
LogP 11.65384
Topological Polar Surface Area 108.7 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 8
Exact Mass 702.27435
Monoisotopic Mass 702.27435
Heavy Atoms 54
Complexity 2742.4204

Chemical Identifiers

CAS Number 548468-97-9
SMILES CC1=CC=CC=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=C(C=C4)N=NC5=CC=CC=C5)NC(=O)C6=CC(=NC7=CC=CC=C76)C8=CC=CC=C8C

Product Overview

AC1NDN3N (CAS 548468-97-9), with molecular formula C46H34N6O2 and molecular weight 702.27435 g/mol. IUPAC: 2-(2-methylphenyl)-N-[3-[[2-(2-methylphenyl)quinoline-4-carbonyl]amino]-4-phenyldiazenylphenyl]quinoline-4-carboxamide.

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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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