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Substance Name: Piperazine, 1-(3-pyridinylcarbonyl)-4-(2-(trifluoromethyl)phenyl)-, monohydrochloride
RN: 124444-83-3
InChIKey: ATTSGZBXNWVPJF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H16-F3-N3-O.Cl-H

Molecular Weight

  • 371.7883
 
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Names and Synonyms

Synonyms

  • 1-(3-Pyridinylcarbonyl)-4-(2-(trifluoromethyl)phenyl)piperazine monohydrochloride
  • B-1 363

Systematic Name

  • Piperazine, 1-(3-pyridinylcarbonyl)-4-(2-(trifluoromethyl)phenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 124444-83-3

System Generated Number

  • 0124444833

Molecular Formulas

Molecular Formula

  • C17-H16-F3-N3-O.Cl-H

Molecular Formula Fragments

  • C17-H16-F3-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H16F3N3O.ClH/c18-17(19,20)14-5-1-2-6-15(14)22-8-10-23(11-9-22)16(24)13-4-3-7-21-12-13;/h1-7,12H,8-11H2;1H

InChIKey

ATTSGZBXNWVPJF-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)C(F)(F)F)N2CCN(CC2)C(=O)c3cccnc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4880807,