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Substance Name: Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(2-pyrimidyl)-, oxalate
RN: 22663-53-2
InChIKey: OELWISXAGSHZMH-UHFFFAOYSA-N

Molecular Formula

  • C23-H25-Cl-N4-O.C2-H2-O4

Molecular Weight

  • 498.964
 
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Names and Synonyms

Synonym

  • 1-(2-(alpha-(p-Chlorophenyl)benzyloxy)ethyl)-4-(2-pyrimidyl)piperazine oxalate

Systematic Name

  • Piperazine, 1-(2-(alpha-(p-chlorophenyl)benzyloxy)ethyl)-4-(2-pyrimidyl)-, oxalate

Registry Numbers

CAS Registry Number

  • 22663-53-2

System Generated Number

  • 0022663532

Molecular Formulas

Molecular Formula

  • C23-H25-Cl-N4-O.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C23-H25-Cl-N4-O
  • COMPONENT

Structure Descriptors

InChI

1S/C23H25ClN4O.C2H2O4/c24-21-9-7-20(8-10-21)22(19-5-2-1-3-6-19)29-18-17-27-13-15-28(16-14-27)23-25-11-4-12-26-23;3-1(4)2(5)6/h1-12,22H,13-18H2;(H,3,4)(H,5,6)

InChIKey

OELWISXAGSHZMH-UHFFFAOYSA-N

Smiles

c1(N2CCN(CCO[C@@H](c3ccc(Cl)cc3)c3ccccc3)CC2)ncccn1.OC(C(O)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 860, 1969.