Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1(3H)-Isobenzofuranone, 3-((2-(2-(4-(4-fluorophenyl)-1-piperazinyl)ethyl)phenyl)amino)-
RN: 90494-51-2
InChIKey: GTNJIINHRJEATC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H26-F-N3-O2

Molecular Weight

  • 431.5084
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • ((p-Fluorophenyl-4 piperazinylethyl)-2 anilino)-3 isobenzofurannone
  • ((p-Fluorophenyl-4 piperazinylethyl)-2 anilino)-3 isobenzofurannone [French]
  • 3-((2-(2-(4-(4-Fluorophenyl)-1-piperazinyl)ethyl)phenyl)amino)-1(3H)-isobenzofuranone
  • COR 3437

Systematic Name

  • 1(3H)-Isobenzofuranone, 3-((2-(2-(4-(4-fluorophenyl)-1-piperazinyl)ethyl)phenyl)amino)-

Registry Numbers

CAS Registry Number

  • 90494-51-2

System Generated Number

  • 0090494512

Structure Descriptors

InChI

1S/C26H26FN3O2/c27-20-9-11-21(12-10-20)30-17-15-29(16-18-30)14-13-19-5-1-4-8-24(19)28-25-22-6-2-3-7-23(22)26(31)32-25/h1-12,25,28H,13-18H2

InChIKey

GTNJIINHRJEATC-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)CCN2CCN(CC2)c3ccc(cc3)F)NC4c5ccccc5C(=O)O4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 500mg/kg (500mg/kg)   European Patent Application. Vol. #0100745,
mouse LDLo oral 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #0100745,