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Substance Name: Pyridinium, 3-amino-1-(3-(3-aminophenoxy)-2-hydroxypropyl)-, chloride, dihydrochloride
RN: 64511-92-8
InChIKey: QSDQWGSBDPUIGE-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N3-O2.2Cl-H.Cl

Molecular Weight

  • 368.69
 
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Names and Synonyms

Synonym

  • 3-Amino-1-(3-(3-aminophenoxy)-2-hydroxypropyl)pyridinium chloride dihydrochloride

Systematic Name

  • Pyridinium, 3-amino-1-(3-(3-aminophenoxy)-2-hydroxypropyl)-, chloride, dihydrochloride

Registry Numbers

CAS Registry Number

  • 64511-92-8

System Generated Number

  • 0064511928

Molecular Formulas

Molecular Formula

  • C14-H18-N3-O2.2Cl-H.Cl

Molecular Formula Fragments

  • C14-H18-N3-O2
  • Cl
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18N3O2.3ClH/c15-11-3-1-5-14(7-11)19-10-13(18)9-17-6-2-4-12(16)8-17;;;/h1-8,13,18H,9-10,15-16H2;3*1H/q+1;;;/p-1

InChIKey

QSDQWGSBDPUIGE-UHFFFAOYSA-M

Smiles

c1cc(cc(c1)OCC(C[n+]2cccc(c2)N)O)N.Cl.Cl.[Cl-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 15, Pg. 466, 1977.