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Substance Name: Piperazineethanol, 4-phenyl-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride
RN: 51085-80-4
InChIKey: LQSKLJQPTVDPGT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H27-Cl-N4-O2.2Cl-H

Molecular Weight

  • 559.9221
 
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Names and Synonyms

Synonyms

  • 2-(4-Phenyl-1-piperazinyl)ethyl 2-((7-chloro-4-quinolyl)amino)benzoate dihydrochloride
  • 4-Phenylpiperazineethanol o-(7-chloro-4-quinolylamino)benzoate dihydrochloride

Systematic Name

  • Piperazineethanol, 4-phenyl-, N-(7-chloro-4-quinolyl)anthranilate, dihydrochloride

Registry Numbers

CAS Registry Number

  • 51085-80-4

System Generated Number

  • 0051085804

Molecular Formulas

Molecular Formula

  • C28-H27-Cl-N4-O2.2Cl-H

Molecular Formula Fragments

  • C28-H27-Cl-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C28H27ClN4O2.2ClH/c29-21-10-11-23-26(12-13-30-27(23)20-21)31-25-9-5-4-8-24(25)28(34)35-19-18-32-14-16-33(17-15-32)22-6-2-1-3-7-22;;/h1-13,20H,14-19H2,(H,30,31);2*1H

InChIKey

LQSKLJQPTVDPGT-UHFFFAOYSA-N

Smiles

c1ccc(cc1)N2CCN(CC2)CCOC(=O)c3ccccc3Nc4ccnc5c4ccc(c5)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 4250mg/kg (4250mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 22, Pg. 554, 1979.