Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: BWA-78U hydrochloride
RN: 101190-60-7
UNII: 9TAW9YW2N0
InChIKey: ONJKJJFUXUTARC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-F-N5.Cl-H

Molecular Weight

  • 293.7317
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • BWA-78U hydrochloride

Synonyms

  • 9-(2-Fluorobenzyl)-6-(methylamino)-9H-purine hydrochloride
  • BW A78U hydrochloride
  • UNII-9TAW9YW2N0

Systematic Name

  • 9H-Purin-6-amine, 9-((2-fluorophenyl)methyl)-N-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 101190-60-7

FDA UNII

  • 9TAW9YW2N0

Related Registry Number

  • 101155-02-6 (Parent)

System Generated Number

  • 0101190607

Molecular Formulas

Molecular Formula

  • C13-H12-F-N5.Cl-H

Molecular Formula Fragments

  • C13-H12-F-N5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H12FN5.ClH/c1-15-12-11-13(17-7-16-12)19(8-18-11)6-9-4-2-3-5-10(9)14;/h2-5,7-8H,6H2,1H3,(H,15,16,17);1H

InChIKey

ONJKJJFUXUTARC-UHFFFAOYSA-N

Smiles

CNc1c2c(ncn1)n(cn2)Cc3ccccc3F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg) BEHAVIORAL: ATAXIA Journal of Medicinal Chemistry. Vol. 29, Pg. 1133, 1986.
rat LD50 oral > 1gm/kg (1000mg/kg) BEHAVIORAL: ATAXIA Journal of Medicinal Chemistry. Vol. 29, Pg. 1133, 1986.