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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-8-ethyl-1-methyl-3-(2-methylpropyl)-
RN: 132560-07-7
InChIKey: BQGHPCHYESRVHK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-N4-O2

Molecular Weight

  • 250.3002
 
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Names and Synonyms

Synonyms

  • BRN 4194840
  • Xanthine, 8-ethyl-3-isobutyl-1-methyl-

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-8-ethyl-1-methyl-3-(2-methylpropyl)-

Registry Numbers

CAS Registry Number

  • 132560-07-7

System Generated Number

  • 0132560077

Structure Descriptors

InChI

1S/C12H18N4O2/c1-5-8-13-9-10(14-8)16(6-7(2)3)12(18)15(4)11(9)17/h7H,5-6H2,1-4H3,(H,13,14)

InChIKey

BQGHPCHYESRVHK-UHFFFAOYSA-N

Smiles

CCc1[nH]c2c(n1)n(c(=O)n(c2=O)C)CC(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 46mg/kg (46mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 25, Pg. 653, 1990.