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Substance Name: 1H-Purine, 8-(2-methoxy-4-(methylthio)phenyl)-
RN: 77456-44-1
InChIKey: XHVSPLBWACNWCF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-N4-O-S

Molecular Weight

  • 272.3308
 
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Names and Synonyms

Synonyms

  • 8-(2-Methoxy-4-(methylthio)phenyl)-1H-purine
  • 8-(2-Methoxy-4-methylmercapto-phenyl)-purin
  • 8-(2-Methoxy-4-methylmercapto-phenyl)-purin [German]

Systematic Name

  • 1H-Purine, 8-(2-methoxy-4-(methylthio)phenyl)-

Registry Numbers

CAS Registry Number

  • 77456-44-1

System Generated Number

  • 0077456441

Structure Descriptors

InChI

1S/C13H12N4OS/c1-18-11-5-8(19-2)3-4-9(11)12-16-10-6-14-7-15-13(10)17-12/h3-7H,1-2H3,(H,14,15,16,17)

InChIKey

XHVSPLBWACNWCF-UHFFFAOYSA-N

Smiles

COc1cc(ccc1c2nc-3c[nH]cnc3n2)SC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo oral 300mg/kg (300mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2927988,