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Substance Name: Phenanthridinium, 3,8-diamino-5-methyl-6-(2-thienyl)-, bromide
RN: 109654-95-7
InChIKey: NHDXFEBPMLIXCQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H16-N3-S.Br

Molecular Weight

  • 386.3154
 
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Names and Synonyms

Synonyms

  • 3,8-Diamino-5-methyl-6-(2-thienyl)phenanthridinium bromide
  • 621C47

Systematic Name

  • Phenanthridinium, 3,8-diamino-5-methyl-6-(2-thienyl)-, bromide

Registry Numbers

CAS Registry Number

  • 109654-95-7

System Generated Number

  • 0109654957

Molecular Formulas

Molecular Formula

  • C18-H16-N3-S.Br

Molecular Formula Fragments

  • Br
  • C18-H16-N3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C18H15N3S.BrH/c1-21-16-10-12(20)5-7-14(16)13-6-4-11(19)9-15(13)18(21)17-3-2-8-22-17;/h2-10,20H,19H2,1H3;1H

InChIKey

NHDXFEBPMLIXCQ-UHFFFAOYSA-N

Smiles

C[n+]1c2cc(ccc2c3ccc(cc3c1c4cccs4)N)N.[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 12mg/kg (12mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 5, Pg. 261, 1950.