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Substance Name: 2(3H)-Oxazolone, 4-(4-fluorophenyl)-5-(2-(4-(3-methoxyphenyl)-1-piperazinyl)ethyl)-, monohydrochloride
RN: 120944-10-7
InChIKey: MRPPZCUNEBEVES-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H24-F-N3-O2.Cl-H

Molecular Weight

  • 433.9085
 
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Names and Synonyms

Synonym

  • 4-(4-Fluorophenyl)-5-(2-(4-(3-methoxyphenyl)-1-piperazinyl)ethyl)-2(3H)-oxazolone HCl

Systematic Name

  • 2(3H)-Oxazolone, 4-(4-fluorophenyl)-5-(2-(4-(3-methoxyphenyl)-1-piperazinyl)ethyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 120944-10-7

System Generated Number

  • 0120944107

Molecular Formulas

Molecular Formula

  • C22-H24-F-N3-O2.Cl-H

Molecular Formula Fragments

  • C22-H24-F-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24FN3O3.ClH/c1-28-19-4-2-3-18(15-19)26-13-11-25(12-14-26)10-9-20-21(24-22(27)29-20)16-5-7-17(23)8-6-16;/h2-8,15H,9-14H2,1H3,(H,24,27);1H

InChIKey

MRPPZCUNEBEVES-UHFFFAOYSA-N

Smiles

COc1cccc(c1)N2CCN(CC2)CCc3c([nH]c(=O)o3)c4ccc(cc4)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 2241, 1989.