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Substance Name: 3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(3,4,5-trimethoxyphenyl)-
RN: 108132-84-9
InChIKey: ITZKQCRVJLEYCF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H13-N3-O4

Molecular Weight

  • 251.2407
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-5-(3,4,5-trimethoxyphenyl)-3H-1,2,4-triazol-3-one
  • BRN 5977699

Systematic Name

  • 3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(3,4,5-trimethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 108132-84-9

System Generated Number

  • 0108132849

Structure Descriptors

InChI

1S/C11H13N3O4/c1-16-7-4-6(10-12-11(15)14-13-10)5-8(17-2)9(7)18-3/h4-5H,1-3H3,(H2,12,13,14,15)

InChIKey

ITZKQCRVJLEYCF-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)c2[nH][nH]c(=O)n2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 300mg/kg (300mg/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.