Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-diethyl-8-(2-(3-phenoxyphenyl)ethenyl)-, (E)-
RN: 155814-35-0
InChIKey: BQXHAENPWKQCCC-BUHFOSPRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H22-N4-O3

Molecular Weight

  • 402.4518
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • (E)-1,3-Diethyl-8-(2-(3-phenoxyphenyl)ethenyl)-3,7-dihydro-1H-purine-2,6-dione
  • (E)-1,3-Diethyl-8-(3-phenoxystyryl)xanthine

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 155814-35-0

System Generated Number

  • 0155814350

Structure Descriptors

InChI

1S/C23H22N4O3/c1-3-26-21-20(22(28)27(4-2)23(26)29)24-19(25-21)14-13-16-9-8-12-18(15-16)30-17-10-6-5-7-11-17/h5-15H,3-4H2,1-2H3,(H,24,25)/b14-13+

InChIKey

BQXHAENPWKQCCC-BUHFOSPRSA-N

Smiles

CCn1c2c(c(=O)n(c1=O)CC)[nH]c(n2)/C=C/c3cccc(c3)Oc4ccccc4

Toxicity

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