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Substance Name: 1H-Inden-1-one, 2,3-dihydro-6-fluoro-2-((4-(4-methoxyphenyl)-1-piperazinyl)methylene)-
RN: 65201-47-0
InChIKey: DQXQAKVSWFOJQZ-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-6-fluoro-2-((4-(4-methoxyphenyl)-1-piperazinyl)methylene)-1H-inden-1-one
  • 5-23-02-00226 (Beilstein Handbook Reference)
  • BRN 0835518

Systematic Name

  • 1H-Inden-1-one, 2,3-dihydro-6-fluoro-2-((4-(4-methoxyphenyl)-1-piperazinyl)methylene)-

Registry Numbers

CAS Registry Number

  • 65201-47-0

System Generated Number

  • 0065201470

Structure Descriptors

InChI

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

InChIKey

DQXQAKVSWFOJQZ-UHFFFAOYSA-N

Smiles

C(\N1CCN(CC1)c1ccc(OC)cc1)=C1/C(c2cc(F)ccc2C1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 15, Pg. 641, 1977.