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Substance Name: Isaxonine phosphate
RN: 65606-21-5
UNII: S52Q6EHI7F
InChIKey: CXEBHWXMQKIKPJ-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Human Data

Molecular Formula

  • C7-H11-N3.H3-O4-P

Molecular Weight

  • 235.179
 
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Names and Synonyms

Name of Substance

  • Isaxonine phosphate

Synonyms

  • 2-Isopropylaminopyrimidine orthophosphate
  • EINECS 265-845-1
  • Isaxonine phosphate
  • Isaxorine
  • N-(1-Methylethyl)-2-pyrimidinamine phosphate
  • Nerfactor
  • UNII-S52Q6EHI7F

Systematic Names

  • 2-Pyrimidinamine, N-(1-methylethyl)-, phosphate (1:1)
  • N-Isopropylpyrimidin-2-amine phosphate (1:1)

Registry Numbers

CAS Registry Number

  • 65606-21-5

FDA UNII

  • S52Q6EHI7F

Other Registry Number

  • 64571-05-7

System Generated Number

  • 0065606215

Molecular Formulas

Molecular Formula

  • C7-H11-N3.H3-O4-P

Molecular Formula Fragments

  • C7-H11-N3
  • COMPONENT
  • H3-O4-P

Structure Descriptors

InChI

1S/C7H11N3.H3O4P/c1-6(2)10-7-8-4-3-5-9-7;1-5(2,3)4/h3-6H,1-2H3,(H,8,9,10);(H3,1,2,3,4)

InChIKey

CXEBHWXMQKIKPJ-UHFFFAOYSA-N

Smiles

c1(NC(C)C)ncccn1.P(=O)(O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
man TDLo oral 1821mg/kg/16W (1821mg/kg) LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), ZONAL" Therapie. Vol. 39, Pg. 537, 1984.
mouse LD50 intraperitoneal 1530mg/kg (1530mg/kg)   United States Patent Document. Vol. #4073895,
mouse LD50 oral 2830mg/kg (2830mg/kg)   United States Patent Document. Vol. #4073895,