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Substance Name: Piperazine, 1-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(4-fluorophenyl)-, N-oxide, dihydrochloride
RN: 106101-39-7
InChIKey: XXFGJTZCGAZZST-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H19-F-N4-O3.2Cl-H

Molecular Weight

  • 419.2819
 
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Names and Synonyms

Synonym

  • 1-(2,6-Dimethyl-3-nitro-4-pyridinyl)-4-(4-fluorophenyl)piperazine N-oxide dihydrochloride

Systematic Name

  • Piperazine, 1-(2,6-dimethyl-3-nitro-4-pyridinyl)-4-(4-fluorophenyl)-, N-oxide, dihydrochloride

Registry Numbers

CAS Registry Number

  • 106101-39-7

System Generated Number

  • 0106101397

Molecular Formulas

Molecular Formula

  • C17-H19-F-N4-O3.2Cl-H

Molecular Formula Fragments

  • C17-H19-F-N4-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H19FN4O3.2ClH/c1-12-11-16(17(22(24)25)13(2)21(12)23)20-9-7-19(8-10-20)15-5-3-14(18)4-6-15;;/h3-6,11H,7-10H2,1-2H3;2*1H

InChIKey

XXFGJTZCGAZZST-UHFFFAOYSA-N

Smiles

Cc1cc(c(c(n1=O)C)[N+](=O)[O-])N2CCN(CC2)c3ccc(cc3)F.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 200mg/kg (200mg/kg)   United States Patent Document. Vol. #4859663,