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Substance Name: Phenol, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2-methoxy-, monohydrobromide
RN: 122439-97-8
InChIKey: GHBRBLNGRSGPEP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H14-N4-O2.Br-H

Molecular Weight

  • 327.1805
 
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Names and Synonyms

Synonyms

  • 2,4-Diamino-5-(3-methoxy-4-hydroxybenzyl)pyrimidine hydrobromide
  • 4-((2,4-Diamino-5-pyrimidinyl)methyl)-2-methoxyphenol monohydrobromide

Systematic Name

  • Phenol, 4-((2,4-diamino-5-pyrimidinyl)methyl)-2-methoxy-, monohydrobromide

Registry Numbers

CAS Registry Number

  • 122439-97-8

System Generated Number

  • 0122439978

Molecular Formulas

Molecular Formula

  • C12-H14-N4-O2.Br-H

Molecular Formula Fragments

  • Br-H
  • C12-H14-N4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C12H14N4O2.BrH/c1-18-10-5-7(2-3-9(10)17)4-8-6-15-12(14)16-11(8)13;/h2-3,5-6,17H,4H2,1H3,(H4,13,14,15,16);1H

InChIKey

GHBRBLNGRSGPEP-UHFFFAOYSA-N

Smiles

COc1cc(ccc1O)Cc2cnc(nc2N)N.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #4883798,