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Substance Name: 1-Piperazinecarboxamide, N-((dimethylamino)carbonyl)-4-(4-hydroxy-3-(trifluoromethyl)phenyl)-N-methyl-
RN: 80712-39-6
InChIKey: YJKWFQGFICQUKJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H21-F3-N4-O3

Molecular Weight

  • 374.3609
 
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Names and Synonyms

Synonym

  • 1-(3-Trifluoromethyl-4-hydroxyphenyl)-4-(2,4,4-trimethylallophanoyl)piperazine

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 80712-39-6

System Generated Number

  • 0080712396

Structure Descriptors

InChI

1S/C16H21F3N4O3/c1-20(2)14(25)21(3)15(26)23-8-6-22(7-9-23)11-4-5-13(24)12(10-11)16(17,18)19/h4-5,10,24H,6-9H2,1-3H3

InChIKey

YJKWFQGFICQUKJ-UHFFFAOYSA-N

Smiles

CN(C)C(=O)N(C)C(=O)N1CCN(CC1)c2ccc(O)c(c2)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 2gm/kg (2000mg/kg)   United States Patent Document. Vol. #4666911,