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Substance Name: 1,3-Dioxol-2-one, 4-(4-fluorophenyl)-5-(2-(4-(3-trifluoromethylphenyl)-1-piperazinyl)ethyl)-, hydrochloride
RN: 71923-23-4
InChIKey: VCYBANKNPXVPKU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H20-F4-N2-O3.Cl-H

Molecular Weight

  • 472.864
 
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Names and Synonyms

  • 1,3-Dioxol-2-one, 4-(4-fluorophenyl)-5-(2-(4-(3-trifluoromethylphenyl)-1-piperazinyl)ethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 71923-23-4

System Generated Number

  • 0071923234

Molecular Formulas

Molecular Formula

  • C22-H20-F4-N2-O3.Cl-H

Molecular Formula Fragments

  • C22-H20-F4-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H20F4N2O3.ClH/c23-17-6-4-15(5-7-17)20-19(30-21(29)31-20)8-9-27-10-12-28(13-11-27)18-3-1-2-16(14-18)22(24,25)26;/h1-7,14H,8-13H2;1H

InChIKey

VCYBANKNPXVPKU-UHFFFAOYSA-N

Smiles

c1(c(oc(o1)=O)CC[NH+]1CCN(c2cc(ccc2)C(F)(F)F)CC1)c1ccc(F)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 28, Pg. 815, 1985.