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Substance Name: Pyridinium, 4,4'-(pimeloylbis(imino-p-phenyleneimino))bis(1-ethyl-, diperchlorate
RN: 60172-03-4
InChIKey: UNMIOXGJMDTNPB-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C33-H40-N6-O2.2Cl-O4

Molecular Weight

  • 751.617
 
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Names and Synonyms

Synonym

  • 4,4'-(Pimeloylbis(imino-p-phenyleneimino))bis(1-ethylpyridinium) diperchlorate

Systematic Name

  • Pyridinium, 4,4'-(pimeloylbis(imino-p-phenyleneimino))bis(1-ethyl-, diperchlorate

Registry Numbers

CAS Registry Number

  • 60172-03-4

System Generated Number

  • 0060172034

Molecular Formulas

Molecular Formula

  • C33-H40-N6-O2.2Cl-O4

Molecular Formula Fragments

  • C33-H40-N6-O2
  • Cl-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C33H38N6O2.2ClHO4/c1-3-38-22-18-30(19-23-38)34-26-10-14-28(15-11-26)36-32(40)8-6-5-7-9-33(41)37-29-16-12-27(13-17-29)35-31-20-24-39(4-2)25-21-31;2*2-1(3,4)5/h10-25H,3-9H2,1-2H3,(H2,36,37,40,41);2*(H,2,3,4,5)

InChIKey

UNMIOXGJMDTNPB-UHFFFAOYSA-N

Smiles

CC[n+]1ccc(cc1)Nc2ccc(cc2)NC(=O)CCCCCC(=O)Nc3ccc(cc3)Nc4cc[n+](cc4)CC.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 20mg/kg (20mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.