Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2(3H)-Oxazolone, 5-(2-(4-(3,4-dichlorophenyl)-1-piperazinyl)ethyl)-4-(4-fluorophenyl)-, monohydrochloride
RN: 120944-17-4
InChIKey: PVEANDDXKKGGLD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-Cl2-F-N3-O2.Cl-H

Molecular Weight

  • 472.7729
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 120944-17-4

System Generated Number

  • 0120944174

Molecular Formulas

Molecular Formula

  • C21-H20-Cl2-F-N3-O2.Cl-H

Molecular Formula Fragments

  • C21-H20-Cl2-F-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H20Cl2FN3O2.ClH/c22-17-6-5-16(13-18(17)23)27-11-9-26(10-12-27)8-7-19-20(25-21(28)29-19)14-1-3-15(24)4-2-14;/h1-6,13H,7-12H2,(H,25,28);1H

InChIKey

PVEANDDXKKGGLD-UHFFFAOYSA-N

Smiles

c1cc(ccc1c2c(oc(=O)[nH]2)CCN3CCN(CC3)c4ccc(c(c4)Cl)Cl)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 32, Pg. 2241, 1989.