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Substance Name: Quinolinium, 4-((3-amino-4-((4-((1-methylpyridinium-4-yl)amino)benzoyl)amino)phenyl)amino)-1-methyl-, dibromide
RN: 53222-52-9
InChIKey: GMLSVLWOTMTUDT-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C29-H28-N6-O.2Br

Molecular Weight

  • 636.3892
 
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Names and Synonyms

  • Quinolinium, 4-((3-amino-4-((4-((1-methylpyridinium-4-yl)amino)benzoyl)amino)phenyl)amino)-1-methyl-, dibromide

Registry Numbers

CAS Registry Number

  • 53222-52-9

System Generated Number

  • 0053222529

Molecular Formulas

Molecular Formula

  • C29-H28-N6-O.2Br

Molecular Formula Fragments

  • Br
  • C29-H28-N6-O
  • COMPONENT

Structure Descriptors

InChI

1S/C29H26N6O.2BrH/c1-34-16-13-22(14-17-34)31-21-9-7-20(8-10-21)29(36)33-27-12-11-23(19-25(27)30)32-26-15-18-35(2)28-6-4-3-5-24(26)28;;/h3-19H,30H2,1-2H3,(H,33,36);2*1H

InChIKey

GMLSVLWOTMTUDT-UHFFFAOYSA-N

Smiles

C[n+]1ccc(cc1)Nc2ccc(cc2)C(=O)Nc3ccc(cc3N)Nc4cc[n+](c5c4cccc5)C.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 7mg/kg (7mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.