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Substance Name: 1,4-Piperazinediacetamide, N,N'-bis(3,4,5-trimethoxyphenyl)-, dihydrochloride
RN: 68061-37-0
InChIKey: BIPLGJOZBFMMAF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H36-N4-O8.2Cl-H

Molecular Weight

  • 605.5122
 
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Names and Synonyms

Synonym

  • N,N'-Bis(3,4,5-trimethoxyphenyl)-1,4-piperazinediacetamide dihydrochloride

Systematic Name

  • 1,4-Piperazinediacetamide, N,N'-bis(3,4,5-trimethoxyphenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 68061-37-0

System Generated Number

  • 0068061370

Molecular Formulas

Molecular Formula

  • C26-H36-N4-O8.2Cl-H

Molecular Formula Fragments

  • C26-H36-N4-O8
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H36N4O8.2ClH/c1-33-19-11-17(12-20(34-2)25(19)37-5)27-23(31)15-29-7-9-30(10-8-29)16-24(32)28-18-13-21(35-3)26(38-6)22(14-18)36-4;;/h11-14H,7-10,15-16H2,1-6H3,(H,27,31)(H,28,32);2*1H

InChIKey

BIPLGJOZBFMMAF-UHFFFAOYSA-N

Smiles

COc1cc(cc(c1OC)OC)NC(=O)CN2CCN(CC2)CC(=O)Nc3cc(c(c(c3)OC)OC)OC.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 5gm/kg (5000mg/kg)   United States Patent Document. Vol. #4252804,