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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-(4-methyl-1-piperazinyl)-
RN: 52943-65-4
InChIKey: RVWNWJSCUDKZBC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-N6-O2

Molecular Weight

  • 278.3142
 
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Names and Synonyms

Synonyms

  • 4-26-00-03988 (Beilstein Handbook Reference)
  • BRN 0303207
  • N(sup 1)-(8-Teofillina)-N(sup 4)-metilpiperazina
  • N(sup 1)-(8-Teofillina)-N(sup 4)-metilpiperazina [Italian]
  • N(sup 1)-(Theophyllinyl-8)-N(sup 4)-methylpiperazine

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-8-(4-methyl-1-piperazinyl)-

Registry Numbers

CAS Registry Number

  • 52943-65-4

System Generated Number

  • 0052943654

Structure Descriptors

InChI

1S/C12H18N6O2/c1-15-4-6-18(7-5-15)11-13-8-9(14-11)16(2)12(20)17(3)10(8)19/h4-7H2,1-3H3,(H,13,14)

InChIKey

RVWNWJSCUDKZBC-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)c2nc3N(C)C(=O)N(C)C(=O)c3[nH]2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 900mg/kg (900mg/kg)   Farmaco, Edizione Scientifica. Vol. 29, Pg. 802, 1974.
rat LD50 intravenous 640mg/kg (640mg/kg)   Farmaco, Edizione Scientifica. Vol. 29, Pg. 802, 1974.