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Substance Name: 1(2H)-Phthalazinone, 4-((4-chlorophenyl)methyl)-2-(8-(phenylmethyl)-8-azabicyclo(3.2.1)oct-3-yl)-, monohydrochloride
RN: 110406-75-2
InChIKey: ITDXOEQWYOEUKI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H28-Cl-N3-O.Cl-H

Molecular Weight

  • 506.4741
 
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Names and Synonyms

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

Registry Numbers

CAS Registry Number

  • 110406-75-2

System Generated Number

  • 0110406752

Molecular Formulas

Molecular Formula

  • C29-H28-Cl-N3-O.Cl-H

Molecular Formula Fragments

  • C29-H28-Cl-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H28ClN3O.ClH/c30-22-12-10-20(11-13-22)16-28-26-8-4-5-9-27(26)29(34)33(31-28)25-17-23-14-15-24(18-25)32(23)19-21-6-2-1-3-7-21;/h1-13,23-25H,14-19H2;1H

InChIKey

ITDXOEQWYOEUKI-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CN2C3CCC2CC(C3)n4c(=O)c5ccccc5c(n4)Cc6ccc(cc6)Cl.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,