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Substance Name: 2-Piperidinone, 1-(3-(4-(p-chloro-alpha-hydroxy-alpha-phenylbenzyl)piperidino)phenyl)-6-phenyl-, ethanedioate, hydrate
RN: 109758-39-6
InChIKey: GQQNBXKCIPIPRO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C32-H37-Cl-N2-O2.C2-H2-O4.H2-O

Molecular Weight

  • 607.1431
 
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Names and Synonyms

Synonym

  • M.G. 16260

Systematic Name

  • 2-Piperidinone, 1-(3-(4-(p-chloro-alpha-hydroxy-alpha-phenylbenzyl)piperidino)phenyl)-6-phenyl-, ethanedioate, hydrate

Registry Numbers

CAS Registry Number

  • 109758-39-6

System Generated Number

  • 0109758396

Molecular Formulas

Molecular Formula

  • C32-H37-Cl-N2-O2.C2-H2-O4.H2-O

Molecular Formula Fragments

  • C2-H2-O4
  • C32-H37-Cl-N2-O2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C32H37ClN2O2.C2H2O4/c33-29-17-15-27(16-18-29)32(37,26-11-5-2-6-12-26)28-19-23-34(24-20-28)21-8-22-35-30(13-7-14-31(35)36)25-9-3-1-4-10-25;3-1(4)2(5)6/h1-6,9-12,15-18,28,30,37H,7-8,13-14,19-24H2;(H,3,4)(H,5,6)

InChIKey

GQQNBXKCIPIPRO-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C2CCCC(=O)N2CCCN3CCC(CC3)C(c4ccccc4)(c5ccc(cc5)Cl)O.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 60mg/kg (60mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 359, 1987.
mouse LD50 oral 400mg/kg (400mg/kg)   Farmaco, Edizione Scientifica. Vol. 42, Pg. 359, 1987.