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Substance Name: 1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-3-oxo-alpha-propyl-, ethyl ester
RN: 108734-84-5
InChIKey: JJHQDDANPWIGKU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H27-N3-O5

Molecular Weight

  • 437.4933
 
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Names and Synonyms

Synonyms

  • 2-(1-Ethoxycarbonyl-1-butyl)-3-oxo-5,6-di(paramethoxyphenyl)-as-triazine
  • Ethyl 5,6-bis(4-methoxyphenyl)-3-oxo-alpha-propyl-1,2,4-triazine-2(3H)-acetate

Systematic Name

  • 1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-3-oxo-alpha-propyl-, ethyl ester

Registry Numbers

CAS Registry Number

  • 108734-84-5

System Generated Number

  • 0108734845

Structure Descriptors

InChI

1S/C24H27N3O5/c1-5-7-20(23(28)32-6-2)27-24(29)25-21(16-8-12-18(30-3)13-9-16)22(26-27)17-10-14-19(31-4)15-11-17/h8-15,20H,5-7H2,1-4H3

InChIKey

JJHQDDANPWIGKU-UHFFFAOYSA-N

Smiles

CCCC(C(=O)OCC)n1c(=O)nc(c(n1)c2ccc(cc2)OC)c3ccc(cc3)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4677105,