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Substance Name: 1H-v-Triazolo(4,5-c)pyridine, 1-phenethyl-, monohydrochloride
RN: 16870-86-3
InChIKey: ZQRIEUJRFFXCOE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-N4.Cl-H

Molecular Weight

  • 260.727
 
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Names and Synonyms

Synonyms

  • 1-(beta-Phenylethyl)triazolo(4,5-c)pyridine hydrochloride
  • PCA9

Systematic Names

  • 1H-1,2,3-Triazolo(4,5-c)pyridine, 1-(2-phenylethyl)-, monohydrochloride (9CI)
  • 1H-v-Triazolo(4,5-c)pyridine, 1-phenethyl-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 16870-86-3

System Generated Number

  • 0016870863

Molecular Formulas

Molecular Formula

  • C13-H12-N4.Cl-H

Molecular Formula Fragments

  • C13-H12-N4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H12N4.ClH/c1-2-4-11(5-3-1)7-9-17-13-6-8-14-10-12(13)15-16-17;/h1-6,8,10H,7,9H2;1H

InChIKey

ZQRIEUJRFFXCOE-UHFFFAOYSA-N

Smiles

c1(CCn2nnc3c2ccnc3)ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 414mg/kg (414mg/kg)   Japanese Journal of Pharmacology. Vol. 17, Pg. 622, 1967.
mouse LD50 intravenous 174mg/kg (174mg/kg)   Japanese Journal of Pharmacology. Vol. 17, Pg. 622, 1967.
mouse LD50 oral 850mg/kg (850mg/kg)   Japanese Journal of Pharmacology. Vol. 17, Pg. 622, 1967.