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Substance Name: Propiophenone, 3-(4-(p-fluorophenyl)-1-piperazinyl)-3',4',5'-trimethoxy-, monohydrochloride
RN: 22662-30-2
InChIKey: PSDNAYMRLQZRGS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-F-N2-O4.Cl-H

Molecular Weight

  • 438.924
 
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Names and Synonyms

Synonyms

  • 3-(4-(p-Fluorophenyl)-1-piperazinyl)-3',4',5'-trimethoxypropiophenone hydrochloride
  • N(sup 1)-(beta-(3,4,5-Trimethoxybenzoyl)ethyl)-N(sup 4)-(p-fluorophenyl)piperazine HCl

Systematic Name

  • Propiophenone, 3-(4-(p-fluorophenyl)-1-piperazinyl)-3',4',5'-trimethoxy-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 22662-30-2

System Generated Number

  • 0022662302

Molecular Formulas

Molecular Formula

  • C22-H27-F-N2-O4.Cl-H

Molecular Formula Fragments

  • C22-H27-F-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27FN2O4.ClH/c1-27-20-14-16(15-21(28-2)22(20)29-3)19(26)8-9-24-10-12-25(13-11-24)18-6-4-17(23)5-7-18;/h4-7,14-15H,8-13H2,1-3H3;1H

InChIKey

PSDNAYMRLQZRGS-UHFFFAOYSA-N

Smiles

C(CCN1CCN(CC1)c1ccc(cc1)F)(=O)c1cc(c(c(c1)OC)OC)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 865, 1969.