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Substance Name: Piperazine, 1-(o-chlorobenzyl)-4-(3,4,5-trimethoxybenzoyl)-, hydrochloride
RN: 18907-66-9
InChIKey: RQACRZXEXMAHDF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-Cl-N2-O4.Cl-H

Molecular Weight

  • 441.352
 
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Names and Synonyms

Synonym

  • 1-(o-Chlorobenzyl)-4-(3,4,5-trimethoxybenzoyl)piperazine hydrochloride

Systematic Name

  • Piperazine, 1-(o-chlorobenzyl)-4-(3,4,5-trimethoxybenzoyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 18907-66-9

System Generated Number

  • 0018907669

Molecular Formulas

Molecular Formula

  • C21-H26-Cl-N2-O4.Cl-H

Molecular Formula Fragments

  • C21-H26-Cl-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25ClN2O4.ClH/c1-26-18-12-16(13-19(27-2)20(18)28-3)21(25)24-10-8-23(9-11-24)14-15-6-4-5-7-17(15)22;/h4-7,12-13H,8-11,14H2,1-3H3;1H

InChIKey

RQACRZXEXMAHDF-UHFFFAOYSA-N

Smiles

N1(CCN(CC1)C(c1cc(c(c(c1)OC)OC)OC)=O)Cc1c(cccc1)Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 586mg/kg (586mg/kg)   Journal of Medicinal Chemistry. Vol. 11, Pg. 801, 1968.