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Substance Name: 1-Piperazinecarboxamide, N-methyl-N-((phenylamino)carbonyl)-4-(3-(trifluoromethyl)phenyl)-
RN: 80712-56-7
InChIKey: WBXLTEIQUVCAOU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H21-F3-N4-O2

Molecular Weight

  • 406.4059
 
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Names and Synonyms

Synonyms

  • 1-(2-Methyl-4-phenylallophanoyl)-4-(m-trifluoromethylphenyl)piperazine
  • N-Methyl-N-((phenylamino)carbonyl)-4-(3-(trifluoromethyl)phenyl)-1-piperazinecarboxamide

Systematic Name

  • 1-Piperazinecarboxamide, N-methyl-N-((phenylamino)carbonyl)-4-(3-(trifluoromethyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 80712-56-7

System Generated Number

  • 0080712567

Structure Descriptors

InChI

1S/C20H21F3N4O2/c1-25(18(28)24-16-7-3-2-4-8-16)19(29)27-12-10-26(11-13-27)17-9-5-6-15(14-17)20(21,22)23/h2-9,14H,10-13H2,1H3,(H,24,28)

InChIKey

WBXLTEIQUVCAOU-UHFFFAOYSA-N

Smiles

CN(C(=O)Nc1ccccc1)C(=O)N2CCN(CC2)c3cccc(c3)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4666911,