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Substance Name: Azabuperone hydrochloride
RN: 3162-75-2
UNII: 7WH972M21R
InChIKey: HXBNUKBXKYCOQW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-F-N2-O.2Cl-H

Molecular Weight

  • 363.302
 
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Names and Synonyms

Name of Substance

  • Azabuperone hydrochloride

Synonyms

  • 1-Butanone, 1-(4-fluorophenyl)-4-(hexahydropyrrolo(1,2-a)pyrazin-2(1H)-yl)-, dihydrochloride
  • Azabutyrone
  • UNII-7WH972M21R

Systematic Name

  • Butyrophenone, 4'-fluoro-4-(hexahydropyrrolo(1,2-a)pyrazin-2(1H)-yl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 3162-75-2

FDA UNII

  • 7WH972M21R

Related Registry Number

  • 2856-81-7 (Parent)

System Generated Number

  • 0003162752

Molecular Formulas

Molecular Formula

  • C17-H23-F-N2-O.2Cl-H

Molecular Formula Fragments

  • C17-H23-F-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H23FN2O.2ClH/c18-15-7-5-14(6-8-15)17(21)4-2-9-19-11-12-20-10-1-3-16(20)13-19;;/h5-8,16H,1-4,9-13H2;2*1H

InChIKey

HXBNUKBXKYCOQW-UHFFFAOYSA-N

Smiles

C1[C@@H]2[N@@](CC[N@@]1CCCC(c1ccc(cc1)F)=O)CCC2.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Pharmaceutical Chemistry Journal Vol. 10, Pg. 471, 1976.
mouse LD50 intravenous 74mg/kg (74mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Pharmaceutical Chemistry Journal Vol. 10, Pg. 471, 1976.
rat LD50 intraperitoneal 103mg/kg (103mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Pharmaceutical Chemistry Journal Vol. 10, Pg. 471, 1976.
rat LD50 intravenous 43mg/kg (43mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)
Pharmaceutical Chemistry Journal Vol. 10, Pg. 471, 1976.