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Substance Name: Piperazine, 1-(2-pyridyl)-4-(3-(3,4,5-trimethoxyphenyl)propyl)-, oxalate (1:1)
RN: 23770-99-2
InChIKey: GJZCRNFYWMDXNL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N3-O3.C2-H2-O4

Molecular Weight

  • 461.512
 
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Names and Synonyms

Synonym

  • 1-(2-Pyridyl)-4-(3-(3,4,5-trimethoxyphenyl)propyl)piperazine oxalate (1:1)

Systematic Name

  • Piperazine, 1-(2-pyridyl)-4-(3-(3,4,5-trimethoxyphenyl)propyl)-, oxalate (1:1)

Registry Numbers

CAS Registry Number

  • 23770-99-2

System Generated Number

  • 0023770992

Molecular Formulas

Molecular Formula

  • C21-H29-N3-O3.C2-H2-O4

Molecular Formula Fragments

  • C2-H2-O4
  • C21-H29-N3-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C21H29N3O3.C2H2O4/c1-25-18-15-17(16-19(26-2)21(18)27-3)7-6-10-23-11-13-24(14-12-23)20-8-4-5-9-22-20;3-1(4)2(5)6/h4-5,8-9,15-16H,6-7,10-14H2,1-3H3;(H,3,4)(H,5,6)

InChIKey

GJZCRNFYWMDXNL-UHFFFAOYSA-N

Smiles

N1(c2ccccn2)CCN(CCCc2cc(c(c(c2)OC)OC)OC)CC1.C(C(=O)O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 12, Pg. 865, 1969.