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Substance Name: Benzamide, N-(3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)propyl)-3,4,5-trimethoxy-
RN: 71016-20-1
InChIKey: NYQNDZXHHNFPLO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N5-O6

Molecular Weight

  • 431.4465
 
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Names and Synonyms

Synonyms

  • 5-26-14-00022 (Beilstein Handbook Reference)
  • BRN 0593900

Systematic Name

  • Benzamide, N-(3-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)propyl)-3,4,5-trimethoxy-

Registry Numbers

CAS Registry Number

  • 71016-20-1

System Generated Number

  • 0071016201

Structure Descriptors

InChI

1S/C20H25N5O6/c1-23-17-15(19(27)24(2)20(23)28)25(11-22-17)8-6-7-21-18(26)12-9-13(29-3)16(31-5)14(10-12)30-4/h9-11H,6-8H2,1-5H3,(H,21,26)

InChIKey

NYQNDZXHHNFPLO-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCNC(=O)c3cc(c(c(c3)OC)OC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 300mg/kg (300mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 14, Pg. 188, 1979.
mouse LD oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 14, Pg. 188, 1979.