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Substance Name: 1(2H)-Phthalazinone, 4-((4-fluorophenyl)methyl)-2-(8-(2-propenyl)-8-azabicyclo(3.2.1)oct-3-yl)-, monohydrochloride
RN: 110406-70-7
InChIKey: WISAKKPNNFFLRE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H26-F-N3-O.Cl-H

Molecular Weight

  • 439.9593
 
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Names and Synonyms

  • 1(2H)-Phthalazinone, 4-((4-fluorophenyl)methyl)-2-(8-(2-propenyl)-8-azabicyclo(3.2.1)oct-3-yl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 110406-70-7

System Generated Number

  • 0110406707

Molecular Formulas

Molecular Formula

  • C25-H26-F-N3-O.Cl-H

Molecular Formula Fragments

  • C25-H26-F-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H26FN3O.ClH/c1-2-13-28-19-11-12-20(28)16-21(15-19)29-25(30)23-6-4-3-5-22(23)24(27-29)14-17-7-9-18(26)10-8-17;/h2-10,19-21H,1,11-16H2;1H

InChIKey

WISAKKPNNFFLRE-UHFFFAOYSA-N

Smiles

C=CCN1C2CCC1CC(C2)n3c(=O)c4ccccc4c(n3)Cc5ccc(cc5)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 500mg/kg (500mg/kg)   United States Patent Document. Vol. #4841047,