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Substance Name: 1,4-Butanediamine, N,N'-bis(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)-, dihydriodide
RN: 82911-00-0
InChIKey: KJWXZXMRBFQEOW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H28-N6.2H-I

Molecular Weight

  • 536.233
 
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Names and Synonyms

Synonym

  • N,N'-Bis(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)-1,4-butanediamine dihydriodide

Systematic Name

  • 1,4-Butanediamine, N,N'-bis(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)-, dihydriodide

Registry Numbers

CAS Registry Number

  • 82911-00-0

System Generated Number

  • 0082911000

Molecular Formulas

Molecular Formula

  • C14-H28-N6.2H-I

Molecular Formula Fragments

  • C14-H28-N6
  • COMPONENT
  • H-I

Structure Descriptors

InChI

1S/C14H28N6.2HI/c1-2-8-16-13(15-7-1)19-11-5-6-12-20-14-17-9-3-4-10-18-14;;/h1-12H2,(H2,15,16,19)(H2,17,18,20);2*1H

InChIKey

KJWXZXMRBFQEOW-UHFFFAOYSA-N

Smiles

C1CCN=C(NC1)NCCCCNC2=NCCCCN2.I.I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 59mg/kg (59mg/kg)   Russian Pharmacology and Toxicology Vol. 45, Pg. 128, 1982.