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Substance Name: Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzylthio)ethyl)-4-(2-thiazolyl)-, oxalate
RN: 23905-07-9
InChIKey: FKPQVJLAFCLIJG-UHFFFAOYSA-N

Molecular Formula

  • C22-H24-Cl-N3-S2.C2-H2-O4

Molecular Weight

  • 520.071
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 23905-07-9

System Generated Number

  • 0023905079

Molecular Formulas

Molecular Formula

  • C22-H24-Cl-N3-S2.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C22-H24-Cl-N3-S2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H24ClN3S2.C2H2O4/c23-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)27-17-15-25-11-13-26(14-12-25)22-24-10-16-28-22;3-1(4)2(5)6/h1-10,16,21H,11-15,17H2;(H,3,4)(H,5,6)

InChIKey

FKPQVJLAFCLIJG-UHFFFAOYSA-N

Smiles

c1(N2CCN(CCS[C@@H](c3ccc(cc3)Cl)c3ccccc3)CC2)nccs1.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.