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Substance Name: Piperazine, 1-(4-fluorophenyl)-4-((3,4,5-trimethoxyphenyl)methyl)-, monohydrochloride
RN: 80305-12-0
InChIKey: VBEFHINCTCYNJA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-F-N2-O3.Cl-H

Molecular Weight

  • 396.8874
 
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Names and Synonyms

Synonyms

  • 1-(4-Fluorophenyl)-4-((3,4,5-trimethoxyphenyl)methyl)piperazine monohydrochloride
  • N-(3,4,5-Trimethoxybenzyl)-N'-(4-fluorophenyl)piperazine hydrochloride

Systematic Name

  • Piperazine, 1-(4-fluorophenyl)-4-((3,4,5-trimethoxyphenyl)methyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 80305-12-0

System Generated Number

  • 0080305120

Molecular Formulas

Molecular Formula

  • C20-H25-F-N2-O3.Cl-H

Molecular Formula Fragments

  • C20-H25-F-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H25FN2O3.ClH/c1-24-18-12-15(13-19(25-2)20(18)26-3)14-22-8-10-23(11-9-22)17-6-4-16(21)5-7-17;/h4-7,12-13H,8-11,14H2,1-3H3;1H

InChIKey

VBEFHINCTCYNJA-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)CN2CCN(CC2)c3ccc(cc3)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 580mg/kg (580mg/kg)   United States Patent Document. Vol. #4370330,
mouse LD50 oral 275mg/kg (275mg/kg)   United States Patent Document. Vol. #4370330,