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Substance Name: Benzamidine, N'-phenyl-N-(p-(2-piperidinoethoxy)phenyl)-,dihydrobromide
RN: 80785-08-6
InChIKey: GSRNYDLWECXRIE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H29-N3-O.2Br-H

Molecular Weight

  • 561.359
 
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Names and Synonyms

Synonym

  • N'-Phenyl-N-(p-(2-piperidinoethoxy)phenyl)benzamidine dihydrobromide

Systematic Name

  • Benzamidine, N'-phenyl-N-(p-(2-piperidinoethoxy)phenyl)-,dihydrobromide

Registry Numbers

CAS Registry Number

  • 80785-08-6

System Generated Number

  • 0080785086

Molecular Formulas

Molecular Formula

  • C26-H29-N3-O.2Br-H

Molecular Formula Fragments

  • Br-H
  • C26-H29-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C26H29N3O.2BrH/c1-4-10-22(11-5-1)26(27-23-12-6-2-7-13-23)28-24-14-16-25(17-15-24)30-21-20-29-18-8-3-9-19-29;;/h1-2,4-7,10-17H,3,8-9,18-21H2,(H,27,28);2*1H

InChIKey

GSRNYDLWECXRIE-UHFFFAOYSA-N

Smiles

C(\c1ccccc1)(Nc1ccc(OCC[NH+]2CCCCC2)cc1)=[N+]/c1ccccc1.[BrH-].[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 142mg/kg (142mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 359, 1982.
mouse LD50 oral 467mg/kg (467mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 359, 1982.