Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Piperazine, 1,1'-(1,4-butanediyl)bis(4-((2,3,4-trimethoxyphenyl)methyl)-, (Z)-2-butenedioate (1:4)
RN: 64966-17-2
InChIKey: YSUUKLBIXSEPGZ-QTQGYALFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C32-H50-N4-O6.4C4-H4-O4

Molecular Weight

  • 1051.0554
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Piperazine, 1,1'-(1,4-butanediyl)bis(4-((2,3,4-trimethoxyphenyl)methyl)-, (Z)-2-butenedioate (1:4)

Registry Numbers

CAS Registry Number

  • 64966-17-2

System Generated Number

  • 0064966172

Molecular Formulas

Molecular Formula

  • C32-H50-N4-O6.4C4-H4-O4

Molecular Formula Fragments

  • C32-H50-N4-O6
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C32H50N4O6.4C4H4O4/c1-37-27-11-9-25(29(39-3)31(27)41-5)23-35-19-15-33(16-20-35)13-7-8-14-34-17-21-36(22-18-34)24-26-10-12-28(38-2)32(42-6)30(26)40-4;4*5-3(6)1-2-4(7)8/h9-12H,7-8,13-24H2,1-6H3;4*1-2H,(H,5,6)(H,7,8)/b;4*2-1+

InChIKey

YSUUKLBIXSEPGZ-QTQGYALFSA-N

Smiles

COc1c(c(c(cc1)CN2CCN(CC2)CCCCN3CCN(CC3)Cc4c(c(c(cc4)OC)OC)OC)OC)OC.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 239mg/kg (239mg/kg)   United States Patent Document. Vol. #4100285,