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Substance Name: Butyrophenone, 4'-fluoro-4-(1,4,5,6-tetrahydro-9-methylazepino(4,5-b)indol-3(2H)-yl)-
RN: 23901-29-3
InChIKey: OONUSIUXUQOPHJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H25-F-N2-O

Molecular Weight

  • 364.461
 
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Names and Synonyms

Synonyms

  • 4'-Fluoro-4-(1,4,5,6-tetrahydro-9-methylazepino(4,5-b)indol-3(2H)-yl)butyrophenone
  • BRN 0701047

Systematic Name

  • Butyrophenone, 4'-fluoro-4-(1,4,5,6-tetrahydro-9-methylazepino(4,5-b)indol-3(2H)-yl)-

Registry Numbers

CAS Registry Number

  • 23901-29-3

System Generated Number

  • 0023901293

Structure Descriptors

InChI

1S/C23H25FN2O/c1-16-4-9-21-20(15-16)19-10-13-26(14-11-22(19)25-21)12-2-3-23(27)17-5-7-18(24)8-6-17/h4-9,15,25H,2-3,10-14H2,1H3

InChIKey

OONUSIUXUQOPHJ-UHFFFAOYSA-N

Smiles

C(CCC[N@@]1CCc2[nH]c3ccc(cc3c2CC1)C)(=O)c1ccc(cc1)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 23, 1970.