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Substance Name: 3,7-Diazabicyclo(3.3.1)nonane, 3,7-dibenzyl-, hydrochloride
RN: 64304-23-0
InChIKey: HHONZOKNSFSZIR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2.Cl-H

Molecular Weight

  • 342.911
 
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Names and Synonyms

Synonyms

  • 3,7-Dibenzyl-3,7-diazabicyclo(3.3.1)nonane hydrochloride
  • 3,7-Dibenzylbispidine hydrochloride

Systematic Name

  • 3,7-Diazabicyclo(3.3.1)nonane, 3,7-dibenzyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 64304-23-0

System Generated Number

  • 0064304230

Molecular Formulas

Molecular Formula

  • C21-H26-N2.Cl-H

Molecular Formula Fragments

  • C21-H26-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N2.ClH/c1-3-7-18(8-4-1)12-22-14-20-11-21(15-22)17-23(16-20)13-19-9-5-2-6-10-19;/h1-10,20-21H,11-17H2;1H

InChIKey

HHONZOKNSFSZIR-UHFFFAOYSA-N

Smiles

N1(Cc2ccccc2)C[C@@H]2C[NH+](Cc3ccccc3)C[C@@H](C1)C2.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 65mg/kg (65mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 1668, 1977.