Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Propiophenone, 3-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)-3',4',5'-trimethoxy-,monohydrochloride
RN: 23771-05-3
InChIKey: BKKODZLDSLOMFY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H27-F3-N2-O4.Cl-H

Molecular Weight

  • 488.931
 
* 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

  • 3-(4-(alpha,alpha,alpha-Trifluoro-m-tolyl)-1-piperazinyl)-3',4',5'-trimethoxypropiophenone HCl

Systematic Name

  • Propiophenone, 3-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)-3',4',5'-trimethoxy-,monohydrochloride

Registry Numbers

CAS Registry Number

  • 23771-05-3

System Generated Number

  • 0023771053

Molecular Formulas

Molecular Formula

  • C23-H27-F3-N2-O4.Cl-H

Molecular Formula Fragments

  • C23-H27-F3-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H27F3N2O4.ClH/c1-30-20-13-16(14-21(31-2)22(20)32-3)19(29)7-8-27-9-11-28(12-10-27)18-6-4-5-17(15-18)23(24,25)26;/h4-6,13-15H,7-12H2,1-3H3;1H

InChIKey

BKKODZLDSLOMFY-UHFFFAOYSA-N

Smiles

C(CCN1CCN(CC1)c1cc(ccc1)C(F)(F)F)(=O)c1cc(c(c(c1)OC)OC)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 865, 1969.