Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Piperazine, 1-(o-chlorophenyl)-4-(2-(alpha-(p-chlorophenyl)benzylthio)ethyl)-, oxalate
RN: 23905-00-2
InChIKey: PANUJQHPGAYGOI-UHFFFAOYSA-N

Molecular Formula

  • C25-H26-Cl2-N2-S.C2-H2-O4

Molecular Weight

  • 547.5
 
* 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

Synonym

  • 1-(o-Chlorophenyl)-4-(2-(alpha-(p-chlorophenyl)benzylthio)ethyl)piperazine oxalate

Systematic Name

  • Piperazine, 1-(o-chlorophenyl)-4-(2-(alpha-(p-chlorophenyl)benzylthio)ethyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 23905-00-2

System Generated Number

  • 0023905002

Molecular Formulas

Molecular Formula

  • C25-H26-Cl2-N2-S.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C25-H26-Cl2-N2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C25H26Cl2N2S.C2H2O4/c26-22-12-10-21(11-13-22)25(20-6-2-1-3-7-20)30-19-18-28-14-16-29(17-15-28)24-9-5-4-8-23(24)27;3-1(4)2(5)6/h1-13,25H,14-19H2;(H,3,4)(H,5,6)

InChIKey

PANUJQHPGAYGOI-UHFFFAOYSA-N

Smiles

N1(c2ccccc2Cl)CCN(CCS[C@@H](c2ccc(Cl)cc2)c2ccccc2)CC1.OC(C(O)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 860, 1969.