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Substance Name: Benzamidine, N-(p-(2-(dibutylamino)ethoxy)phenyl)-N'-phenyl-, dihydrochloride
RN: 80785-00-8
InChIKey: SAIPHXBTCOSCTB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H37-N3-O.2Cl-H

Molecular Weight

  • 516.553
 
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Names and Synonyms

Synonym

  • N-(p-(2-(Dibutylamino)ethoxy)phenyl)-N'-phenyl-benzamidine dihydrochloride

Systematic Name

  • Benzamidine, N-(p-(2-(dibutylamino)ethoxy)phenyl)-N'-phenyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 80785-00-8

System Generated Number

  • 0080785008

Molecular Formulas

Molecular Formula

  • C29-H37-N3-O.2Cl-H

Molecular Formula Fragments

  • C29-H37-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H37N3O.2ClH/c1-3-5-21-32(22-6-4-2)23-24-33-28-19-17-27(18-20-28)31-29(25-13-9-7-10-14-25)30-26-15-11-8-12-16-26;;/h7-20H,3-6,21-24H2,1-2H3,(H,30,31);2*1H

InChIKey

SAIPHXBTCOSCTB-UHFFFAOYSA-N

Smiles

C(\c1ccccc1)(Nc1ccc(OCC[NH+](CCCC)CCCC)cc1)=[N+]/c1ccccc1.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 160mg/kg (160mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 359, 1982.
mouse LD50 oral 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 359, 1982.