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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-methyl-8-(1-methyl-2-phenylethenyl)-, (E)-
RN: 155271-65-1
InChIKey: VSGRBAWAFOQLMA-OUKQBFOZSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H22-N4-O2

Molecular Weight

  • 338.4088
 
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Names and Synonyms

Synonyms

  • (E)-1,3-Diethyl-7-methyl-8-(1-methyl-2-phenylethenyl)-3,7-dihydro-1H-purine-2,6-dione
  • (E)-1,3-Diethyl-7-methyl-8-(alpha-methylstyryl)xanthine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-7-methyl-8-(1-methyl-2-phenylethenyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 155271-65-1

System Generated Number

  • 0155271651

Structure Descriptors

InChI

1S/C19H22N4O2/c1-5-22-17-15(18(24)23(6-2)19(22)25)21(4)16(20-17)13(3)12-14-10-8-7-9-11-14/h7-12H,5-6H2,1-4H3/b13-12+

InChIKey

VSGRBAWAFOQLMA-OUKQBFOZSA-N

Smiles

CCn1c2c(c(=O)n(c1=O)CC)n(c(n2)/C(=C/c3ccccc3)/C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 300mg/kg (300mg/kg)   United States Patent Document. Vol. #5543415,