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Substance Name: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(4-ethoxy-3,5-dimethoxyphenyl)-4-ethyl-
RN: 108132-92-9
InChIKey: PEQKMAZUAWZNLS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H19-N3-O4

Molecular Weight

  • 293.3211
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-5-(4-ethoxy-3,5-dimethoxyphenyl)-4-ethyl-3H-1,2,4-triazol-3-one
  • BRN 5976469

Systematic Name

  • 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(4-ethoxy-3,5-dimethoxyphenyl)-4-ethyl-

Registry Numbers

CAS Registry Number

  • 108132-92-9

System Generated Number

  • 0108132929

Structure Descriptors

InChI

1S/C14H19N3O4/c1-5-17-13(15-16-14(17)18)9-7-10(19-3)12(21-6-2)11(8-9)20-4/h7-8H,5-6H2,1-4H3,(H,16,18)

InChIKey

PEQKMAZUAWZNLS-UHFFFAOYSA-N

Smiles

CCn1c(n[nH]c1=O)c2cc(c(c(c2)OC)OCC)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 400mg/kg (400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.
mammal (species unspecified) LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.