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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(4-(dimethylamino)phenyl)ethenyl)-, (E)-
RN: 155271-92-4
InChIKey: OQKSMHSUAOFGOX-FMIVXFBMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-N5-O2

Molecular Weight

  • 353.4237
 
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Names and Synonyms

Synonyms

  • (E)-1,3-Diethyl-8-(2-(4-(dimethylamino)phenyl)ethenyl)-3,7-dihydro-1H-purine-2,6-dione
  • (E)-8-(4-(N,N-Dimethylamino)styryl)-1,3-diethylxanthine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(4-(dimethylamino)phenyl)ethenyl)-, (E)-

Registry Numbers

CAS Registry Number

  • 155271-92-4

System Generated Number

  • 0155271924

Structure Descriptors

InChI

1S/C19H23N5O2/c1-5-23-17-16(18(25)24(6-2)19(23)26)20-15(21-17)12-9-13-7-10-14(11-8-13)22(3)4/h7-12H,5-6H2,1-4H3,(H,20,21)/b12-9+

InChIKey

OQKSMHSUAOFGOX-FMIVXFBMSA-N

Smiles

CCn1c2c(c(=O)n(c1=O)CC)[nH]c(n2)/C=C/c3ccc(cc3)N(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 100mg/kg (100mg/kg)   United States Patent Document. Vol. #5543415,