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Substance Name: 1-Piperazinecarboxamide, N-((dimethylamino)carbonyl)-N-methyl-4-(4-(trifluoromethyl)phenyl)-
RN: 80712-29-4
InChIKey: DUMHSAYXPWIEAH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H21-F3-N4-O2

Molecular Weight

  • 358.3619
 
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Names and Synonyms

Synonyms

  • 1-(p-Trifluoromethylphenyl)-4-(2,4,4-trimethylallophanoyl)piperazine
  • N-((Dimethylamino)carbonyl)-N-methyl-4-(4-(trifluoromethyl)phenyl)-1-piperazinecarboxamide

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 80712-29-4

System Generated Number

  • 0080712294

Structure Descriptors

InChI

1S/C16H21F3N4O2/c1-20(2)14(24)21(3)15(25)23-10-8-22(9-11-23)13-6-4-12(5-7-13)16(17,18)19/h4-7H,8-11H2,1-3H3

InChIKey

DUMHSAYXPWIEAH-UHFFFAOYSA-N

Smiles

CN(C)C(=O)N(C)C(=O)N1CCN(CC1)c2ccc(cc2)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 281mg/kg (281mg/kg)   United States Patent Document. Vol. #4666911,