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Substance Name: Benzamidine, N-(p-(3-(dibutylamino)propoxy)phenyl)-N'-phenyl-, dihydrochloride
RN: 80785-01-9
InChIKey: MGSOGLGZGWEYGH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H39-N3-O.2Cl-H

Molecular Weight

  • 530.58
 
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Names and Synonyms

Synonym

  • N-(p-(3-(Dibutylamino)propoxy)phenyl)-N'-phenyl-benzamidine dihydrochloride

Systematic Name

  • Benzamidine, N-(p-(3-(dibutylamino)propoxy)phenyl)-N'-phenyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 80785-01-9

System Generated Number

  • 0080785019

Molecular Formulas

Molecular Formula

  • C30-H39-N3-O.2Cl-H

Molecular Formula Fragments

  • C30-H39-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C30H39N3O.2ClH/c1-3-5-22-33(23-6-4-2)24-13-25-34-29-20-18-28(19-21-29)32-30(26-14-9-7-10-15-26)31-27-16-11-8-12-17-27;;/h7-12,14-21H,3-6,13,22-25H2,1-2H3,(H,31,32);2*1H

InChIKey

MGSOGLGZGWEYGH-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 148mg/kg (148mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 359, 1982.
mouse LD50 oral 867mg/kg (867mg/kg)   Journal of Medicinal Chemistry. Vol. 25, Pg. 359, 1982.