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Substance Name: Piperazineethanol, 4-(3-chloro-o-tolyl)-, N-(7-trifluoromethyl-4-quinolyl)anthranilate, dihydrochloride
RN: 55300-41-9
InChIKey: IEPAXIPFDBTIQF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H28-Cl-F3-N4-O2.2Cl-H

Molecular Weight

  • 641.946
 
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Names and Synonyms

  • Piperazineethanol, 4-(3-chloro-o-tolyl)-, N-(7-trifluoromethyl-4-quinolyl)anthranilate, dihydrochloride

Registry Numbers

CAS Registry Number

  • 55300-41-9

System Generated Number

  • 0055300419

Molecular Formulas

Molecular Formula

  • C30-H28-Cl-F3-N4-O2.2Cl-H

Molecular Formula Fragments

  • C30-H28-Cl-F3-N4-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C30H28ClF3N4O2.2ClH/c1-20-24(31)6-4-8-28(20)38-15-13-37(14-16-38)17-18-40-29(39)23-5-2-3-7-25(23)36-26-11-12-35-27-19-21(30(32,33)34)9-10-22(26)27;;/h2-12,19H,13-18H2,1H3,(H,35,36);2*1H

InChIKey

IEPAXIPFDBTIQF-UHFFFAOYSA-N

Smiles

Cc1c(cccc1Cl)N2CCN(CC2)CCOC(=O)c3ccccc3Nc4ccnc5c4ccc(c5)C(F)(F)F.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 3gm/kg (3000mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 22, Pg. 554, 1979.