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Substance Name: 2-Piperidinone, 1-(3-(4-(bis(p-fluorophenyl)methyl)-1-piperazinyl)propyl)-4-phenyl-, ethanedioate
RN: 109758-35-2
InChIKey: JSGMVTOPHWVIGZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C31-H35-F2-N3-O.C2-H2-O4

Molecular Weight

  • 593.6673
 
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Names and Synonyms

Synonyms

  • 1-(3-(4-(Bis(p-fluorophenyl)methyl)-1-piperazinyl)propyl)-4-phenyl-2-piperidinone ethanedioate
  • M.G. 16327

Systematic Name

  • 2-Piperidinone, 1-(3-(4-(bis(p-fluorophenyl)methyl)-1-piperazinyl)propyl)-4-phenyl-, ethanedioate

Registry Numbers

CAS Registry Number

  • 109758-35-2

System Generated Number

  • 0109758352

Molecular Formulas

Molecular Formula

  • C31-H35-F2-N3-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C31-H35-F2-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C31H35F2N3O.C2H2O4/c32-28-11-7-25(8-12-28)31(26-9-13-29(33)14-10-26)36-21-19-34(20-22-36)16-4-17-35-18-15-27(23-30(35)37)24-5-2-1-3-6-24;3-1(4)2(5)6/h1-3,5-14,27,31H,4,15-23H2;(H,3,4)(H,5,6)

InChIKey

JSGMVTOPHWVIGZ-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C2CCN(C(=O)C2)CCCN3CCN(CC3)C(c4ccc(cc4)F)c5ccc(cc5)F.C(=O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 70mg/kg (70mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: EXCITEMENT
Farmaco, Edizione Scientifica. Vol. 42, Pg. 359, 1987.