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Substance Name: Acetic acid, (4-((4-chlorophenyl)methyl)phenoxy)-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester
RN: 57081-58-0
InChIKey: LTGUGXOHPIUKJQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H23-Cl-N4-O5

Molecular Weight

  • 482.9217
 
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Names and Synonyms

Synonyms

  • BRN 1234848
  • Sgd 85-74

Systematic Name

  • Acetic acid, (4-((4-chlorophenyl)methyl)phenoxy)-, 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl ester

Registry Numbers

CAS Registry Number

  • 57081-58-0

System Generated Number

  • 0057081580

Structure Descriptors

InChI

1S/C24H23ClN4O5/c1-27-22-21(23(31)28(2)24(27)32)29(15-26-22)11-12-33-20(30)14-34-19-9-5-17(6-10-19)13-16-3-7-18(25)8-4-16/h3-10,15H,11-14H2,1-2H3

InChIKey

LTGUGXOHPIUKJQ-UHFFFAOYSA-N

Smiles

Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCOC(=O)COc3ccc(cc3)Cc4ccc(cc4)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 29, Pg. 711, 1979.