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Substance Name: Ammonium, hexamethylenebis(diethyl-(beta-(10-phenothiazinyl)ethyl)-, dibromide
RN: 63992-07-4
InChIKey: JPEOONAIYXUZTI-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C42-H56-N4-S2.2Br

Molecular Weight

  • 840.872
 
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Names and Synonyms

Synonym

  • Hexamethylenebis(diethyl-(beta-(10-phenothiazinyl)ethyl)ammonium bromide)

Systematic Name

  • Ammonium, hexamethylenebis(diethyl-(beta-(10-phenothiazinyl)ethyl)-, dibromide

Registry Numbers

CAS Registry Number

  • 63992-07-4

System Generated Number

  • 0063992074

Molecular Formulas

Molecular Formula

  • C42-H56-N4-S2.2Br

Molecular Formula Fragments

  • Br
  • C42-H56-N4-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C42H56N4S2.2BrH/c1-5-45(6-2,33-29-43-35-21-11-15-25-39(35)47-40-26-16-12-22-36(40)43)31-19-9-10-20-32-46(7-3,8-4)34-30-44-37-23-13-17-27-41(37)48-42-28-18-14-24-38(42)44;;/h11-18,21-28H,5-10,19-20,29-34H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

JPEOONAIYXUZTI-UHFFFAOYSA-L

Smiles

N1(c2c(Sc3c1cccc3)cccc2)CC[N+](CCCCCC[N+](CCN1c2c(Sc3c1cccc3)cccc2)(CC)CC)(CC)CC.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 11mg/kg (11mg/kg)   Journal of the American Chemical Society. Vol. 76, Pg. 1862, 1954.