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Substance Name: Butyrophenone, 3',4',5'-trimethoxy-4-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)-, monohydrochloride
RN: 23771-12-2
InChIKey: FUIIBZZLIMCDIH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H29-F3-N2-O4.Cl-H

Molecular Weight

  • 502.958
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 23771-12-2

System Generated Number

  • 0023771122

Molecular Formulas

Molecular Formula

  • C24-H29-F3-N2-O4.Cl-H

Molecular Formula Fragments

  • C24-H29-F3-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H29F3N2O4.ClH/c1-31-21-14-17(15-22(32-2)23(21)33-3)20(30)8-5-9-28-10-12-29(13-11-28)19-7-4-6-18(16-19)24(25,26)27;/h4,6-7,14-16H,5,8-13H2,1-3H3;1H

InChIKey

FUIIBZZLIMCDIH-UHFFFAOYSA-N

Smiles

c1(N2CC[NH+](CCCC(c3cc(c(OC)c(c3)OC)OC)=O)CC2)cc(ccc1)C(F)(F)F.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS
Journal of Medicinal Chemistry. Vol. 12, Pg. 865, 1969.