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Substance Name: 1H-Purine-2,6-dione, 3,7-dihydro-8-(bis(2-(benzoyloxy)ethyl)amino)-1,3,7-trimethyl-
RN: 135101-48-3
InChIKey: PEZNNKUFWFIHIK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H27-N5-O6

Molecular Weight

  • 505.5283
 
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Names and Synonyms

Synonym

  • 8-(Bis(2-(benzoyloxy)ethyl)amino)-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione

Systematic Name

  • 1H-Purine-2,6-dione, 3,7-dihydro-8-(bis(2-(benzoyloxy)ethyl)amino)-1,3,7-trimethyl-

Registry Numbers

CAS Registry Number

  • 135101-48-3

System Generated Number

  • 0135101483

Structure Descriptors

InChI

1S/C26H27N5O6/c1-28-20-21(29(2)26(35)30(3)22(20)32)27-25(28)31(14-16-36-23(33)18-10-6-4-7-11-18)15-17-37-24(34)19-12-8-5-9-13-19/h4-13H,14-17H2,1-3H3

InChIKey

PEZNNKUFWFIHIK-UHFFFAOYSA-N

Smiles

Cn1c2c(nc1N(CCOC(=O)c3ccccc3)CCOC(=O)c4ccccc4)n(c(=O)n(c2=O)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 7343mg/kg (7343mg/kg)   Farmatsiya Vol. 40(4), Pg. 29, 1990.