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Substance Name: 1-Piperazinecarboxamide, N-(5-(7-chloro-4-quinolylamino)-2-methoxybenzyl)-4-methyl-, dihydrochloride
RN: 101976-04-9
InChIKey: XSSNKUKGETXNNJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H26-Cl-N5-O2.2Cl-H

Molecular Weight

  • 512.8662
 
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Names and Synonyms

  • 1-Piperazinecarboxamide, N-(5-(7-chloro-4-quinolylamino)-2-methoxybenzyl)-4-methyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 101976-04-9

System Generated Number

  • 0101976049

Molecular Formulas

Molecular Formula

  • C23-H26-Cl-N5-O2.2Cl-H

Molecular Formula Fragments

  • C23-H26-Cl-N5-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H26ClN5O2.2ClH/c1-28-9-11-29(12-10-28)23(30)26-15-16-13-18(4-6-22(16)31-2)27-20-7-8-25-21-14-17(24)3-5-19(20)21;;/h3-8,13-14H,9-12,15H2,1-2H3,(H,25,27)(H,26,30);2*1H

InChIKey

XSSNKUKGETXNNJ-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)C(=O)NCc2cc(ccc2OC)Nc3ccnc4c3ccc(c4)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 349mg/kg (349mg/kg)   Journal of Medicinal Chemistry. Vol. 24, Pg. 1471, 1981.