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Substance Name: Benzimidazole-3-ethylamine, N-benzyl-, dioxalate
RN: 31488-81-0
InChIKey: PXPQJUCLUBEWTJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N3.2C2-H2-O4

Molecular Weight

  • 431.399
 
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Names and Synonyms

Synonym

  • N-Benzyl-benzimidazole-3-ethylamine dioxalate

Systematic Name

  • Benzimidazole-3-ethylamine, N-benzyl-, dioxalate

Registry Numbers

CAS Registry Number

  • 31488-81-0

System Generated Number

  • 0031488810

Molecular Formulas

Molecular Formula

  • C16-H17-N3.2C2-H2-O4

Molecular Formula Fragments

  • C16-H17-N3
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C16H17N3.2C2H2O4/c1-2-6-14(7-3-1)12-17-10-11-19-13-18-15-8-4-5-9-16(15)19;2*3-1(4)2(5)6/h1-9,13,17H,10-12H2;2*(H,3,4)(H,5,6)

InChIKey

PXPQJUCLUBEWTJ-UHFFFAOYSA-N

Smiles

c12c([nH]c[n+]1CC[NH2+]Cc1ccccc1)cccc2.C(C(=O)[O-])(O)=O.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Pharmaceutical Chemistry Journal Vol. 4, Pg. 606, 1970.