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Substance Name: 7H-Purin-6-amine, 7-(2,3,5,6-tetramethylbenzoyl)-
RN: 36855-76-2
InChIKey: URSBXJCNRRKKLS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N5-O

Molecular Weight

  • 295.344
 
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Names and Synonyms

Synonyms

  • 7-(2,3,5,6-Tetramethylbenzoyl)-7H-purin-6-amine
  • 7-(2,3,5,6-Tetramethylbenzoyl)adenine
  • BRN 1225142

Systematic Name

  • 7H-Purin-6-amine, 7-(2,3,5,6-tetramethylbenzoyl)-

Registry Numbers

CAS Registry Number

  • 36855-76-2

System Generated Number

  • 0036855762

Structure Descriptors

InChI

1S/C16H17N5O/c1-8-5-9(2)11(4)12(10(8)3)16(22)21-7-20-15-13(21)14(17)18-6-19-15/h5-7H,1-4H3,(H2,17,18,19)

InChIKey

URSBXJCNRRKKLS-UHFFFAOYSA-N

Smiles

n1(cnc2ncnc(c12)N)C(c1c(c(cc(c1C)C)C)C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 963, 1971.