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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-8-(4-(2-hydroxyethyl)-1-piperazinyl)-1,3-dimethyl-
RN: 40171-75-3
InChIKey: MFMUXBMPMXPWAT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H20-N6-O3

Molecular Weight

  • 308.34
 
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Names and Synonyms

Synonyms

  • BRN 1161605
  • N(sup 1)-(8-Teofillina)-N(sup 4)-beta-idrossietilpiperazina
  • N(sup 1)-(8-Teofillina)-N(sup 4)-beta-idrossietilpiperazina [Italian]
  • N(sup 1)-(Theophyllinyl-8)-N(sup 4)-beta-hydroxyethylpiperazine

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 40171-75-3

System Generated Number

  • 0040171753

Structure Descriptors

InChI

1S/C13H20N6O3/c1-16-10-9(11(21)17(2)13(16)22)14-12(15-10)19-5-3-18(4-6-19)7-8-20/h20H,3-8H2,1-2H3,(H,14,15)

InChIKey

MFMUXBMPMXPWAT-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)N3CCN(CC3)CCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1675mg/kg (1675mg/kg)   Farmaco, Edizione Scientifica. Vol. 29, Pg. 802, 1974.
mouse LD50 intravenous 640mg/kg (640mg/kg)   Farmaco, Edizione Scientifica. Vol. 29, Pg. 802, 1974.