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Substance Name: 1(2H)-Phthalazinone, 2-(8-(cyclopropylmethyl)-8-azabicyclo(3.2.1)oct-3-yl)-4-((4-fluorophenyl)methyl)-, monohydrochloride
RN: 110406-72-9
InChIKey: CGSAFNYKPRZPJB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H28-F-N3-O.Cl-H

Molecular Weight

  • 453.9861
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 110406-72-9

System Generated Number

  • 0110406729

Molecular Formulas

Molecular Formula

  • C26-H28-F-N3-O.Cl-H

Molecular Formula Fragments

  • C26-H28-F-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H28FN3O.ClH/c27-19-9-7-17(8-10-19)13-25-23-3-1-2-4-24(23)26(31)30(28-25)22-14-20-11-12-21(15-22)29(20)16-18-5-6-18;/h1-4,7-10,18,20-22H,5-6,11-16H2;1H

InChIKey

CGSAFNYKPRZPJB-UHFFFAOYSA-N

Smiles

c1ccc2c(c1)c(nn(c2=O)C3CC4CCC(C3)N4CC5CC5)Cc6ccc(cc6)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,