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Substance Name: Acridinium, 2-amino-10-methyl-9-(p-((p-((1-methylpyridinium-3-yl)carbamoyl)phenyl)carbamoyl)anilino)-, dichloride
RN: 68772-47-4
InChIKey: ADDVVXYNGKFTBK-UHFFFAOYSA-M

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C34-H30-N6-O2.2Cl

Molecular Weight

  • 626.565
 
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Names and Synonyms

  • Acridinium, 2-amino-10-methyl-9-(p-((p-((1-methylpyridinium-3-yl)carbamoyl)phenyl)carbamoyl)anilino)-, dichloride

Registry Numbers

CAS Registry Number

  • 68772-47-4

System Generated Number

  • 0068772474

Molecular Formulas

Molecular Formula

  • C34-H30-N6-O2.2Cl

Molecular Formula Fragments

  • C34-H30-N6-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C34H29N6O2.2ClH/c1-39-19-5-6-27(21-39)38-34(42)23-11-16-26(17-12-23)37-33(41)22-9-14-25(15-10-22)36-32-28-7-3-4-8-30(28)40(2)31-18-13-24(35)20-29(31)32;;/h3-21H,35H2,1-2H3,(H2,37,38,41,42);2*1H/p-1

InChIKey

ADDVVXYNGKFTBK-UHFFFAOYSA-M

Smiles

c1(c2c([n+](C)c3c1cccc3)ccc(c2)N)Nc1ccc(C(Nc2ccc(C(Nc3c[n](ccc3)C)=O)cc2)=O)cc1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 55mg/kg (55mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.