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Substance Name: Piperazine, 1-(1,3-benzodioxol-5-yl)-4-((3,4,5-trimethoxyphenyl)methyl)-, dihydrochloride
RN: 80305-31-3
InChIKey: KQZYMBPXCVFQDF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H26-N2-O5.2Cl-H

Molecular Weight

  • 459.3672
 
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Names and Synonyms

Synonyms

  • 1-(1,3-Benzodioxol-5-yl)-4-((3,4,5-trimethoxyphenyl)methyl)piperazine dihydrochloride
  • N-(3,4,5-Trimethoxybenzyl)-N'-(3,4-methylenedioxyphenyl)piperazine dihydrochloride

Systematic Name

  • Piperazine, 1-(1,3-benzodioxol-5-yl)-4-((3,4,5-trimethoxyphenyl)methyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 80305-31-3

System Generated Number

  • 0080305313

Molecular Formulas

Molecular Formula

  • C21-H26-N2-O5.2Cl-H

Molecular Formula Fragments

  • C21-H26-N2-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H26N2O5.2ClH/c1-24-19-10-15(11-20(25-2)21(19)26-3)13-22-6-8-23(9-7-22)16-4-5-17-18(12-16)28-14-27-17;;/h4-5,10-12H,6-9,13-14H2,1-3H3;2*1H

InChIKey

KQZYMBPXCVFQDF-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)CN2CCN(CC2)c3ccc4c(c3)OCO4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 296mg/kg (296mg/kg)   United States Patent Document. Vol. #4370330,