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Substance Name: 1H-Inden-1-one, 2,3-dihydro-4-fluoro-2-((4-(4-methoxyphenyl)-1-piperazinyl)methylene)-
RN: 65201-45-8
InChIKey: AAHGUNLOJNUIAD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H21-F-N2-O2

Molecular Weight

  • 352.407
 
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Names and Synonyms

Synonyms

  • 2,3-Dihydro-4-fluoro-2-((4-(4-methoxyphenyl)-1-piperazinyl)methylene)-1H-inden-1-one
  • 5-23-02-00225 (Beilstein Handbook Reference)
  • BRN 0838166

Systematic Name

  • 1H-Inden-1-one, 2,3-dihydro-4-fluoro-2-((4-(4-methoxyphenyl)-1-piperazinyl)methylene)-

Registry Numbers

CAS Registry Number

  • 65201-45-8

System Generated Number

  • 0065201458

Structure Descriptors

InChI

1S/C21H21FN2O2/c1-26-17-7-5-16(6-8-17)24-11-9-23(10-12-24)14-15-13-19-18(21(15)25)3-2-4-20(19)22/h2-8,14H,9-13H2,1H3

InChIKey

AAHGUNLOJNUIAD-UHFFFAOYSA-N

Smiles

C(\N1CCN(CC1)c1ccc(cc1)OC)=C1/C(c2cccc(c2C1)F)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 15, Pg. 641, 1977.