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Substance Name: 1-Adamantanecarboxylic acid, 2-(5-(p-tolyl)-3-as-triazinyl)hydrazide, hydrochloride
RN: 77966-95-1
InChIKey: WCTVYHFUCVMFGN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-N5-O.x-Cl-H

Molecular Weight

  • 399.923
 
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Names and Synonyms

  • 1-Adamantanecarboxylic acid, 2-(5-(p-tolyl)-3-as-triazinyl)hydrazide, hydrochloride
  • Tricyclo(3.3.1.13,7)decane-1-carboxylic acid, 2-(5-(4-methylphenyl)-1,2,4-triazin-3-yl)hydrazide, hydrochloride

Registry Numbers

CAS Registry Number

  • 77966-95-1

System Generated Number

  • 0077966951

Molecular Formulas

Molecular Formula

  • C21-H25-N5-O.x-Cl-H

Molecular Formula Fragments

  • C21-H25-N5-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25N5O.ClH/c1-13-2-4-17(5-3-13)18-12-22-25-20(23-18)26-24-19(27)21-9-14-6-15(10-21)8-16(7-14)11-21;/h2-5,12,14-16H,6-11H2,1H3,(H,24,27)(H,23,25,26);1H

InChIKey

WCTVYHFUCVMFGN-UHFFFAOYSA-N

Smiles

C1C2CC3(CC1CC(C2)C3)C(N\N=c1\nc(cn[nH]1)c1ccc(cc1)C)=O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 216mg/kg (216mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 671, 1979.