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Substance Name: Chinoin 170
RN: 88338-63-0
InChIKey: JBXSBZBZASARMY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-N6-O3

Molecular Weight

  • 276.2548
 
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Names and Synonyms

Name of Substance

  • Chinoin 170

Synonyms

  • 3,7-Dihydro-1,3-dimethyl-7-((5-methyl-1,2,4-oxadiazol-3-yl)methyl)-1H-purine-2,6-dione
  • 3-((1,3-Dimethylxanthin-7-yl)methyl)-5-methyl-1,2,4-oxadiazole
  • 7-((5-Methyl-1,2,4-oxadiazol-3-yl)methyl)theophylline
  • Chinoin-170

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-((5-methyl-1,2,4-oxadiazol-3-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 88338-63-0

System Generated Number

  • 0088338630

Structure Descriptors

InChI

1S/C11H12N6O3/c1-6-13-7(14-20-6)4-17-5-12-9-8(17)10(18)16(3)11(19)15(9)2/h5H,4H2,1-3H3

InChIKey

JBXSBZBZASARMY-UHFFFAOYSA-N

Smiles

CN1C(=O)N(C)c2ncn(Cc3noc(C)n3)c2C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 721mg/kg (721mg/kg)   Drugs of the Future. Vol. 10, Pg. 624, 1985.
mouse LD50 intravenous 417mg/kg (417mg/kg)   Drugs of the Future. Vol. 10, Pg. 624, 1985.
mouse LD50 oral 1243mg/kg (1243mg/kg)   Drugs of the Future. Vol. 10, Pg. 624, 1985.
rat LD50 intraperitoneal 530mg/kg (530mg/kg)   United States Patent Document. Vol. #4840949,
rat LD50 intravenous 397mg/kg (397mg/kg)   Drugs of the Future. Vol. 10, Pg. 624, 1985.
rat LD50 oral 1549mg/kg (1549mg/kg)   Drugs of the Future. Vol. 10, Pg. 624, 1985.