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Substance Name: Piperazine, 1-(2-ethoxy-2-(4-pyridyl)ethyl)-4-(o-methoxyphenyl)-, hydrochloride, hemihydrate
RN: 77246-52-7
InChIKey: HAZSAWHMWNKEAN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N3-O2.Cl-H.1/2H2-O

Molecular Weight

  • 377.9132
 
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Names and Synonyms

Synonym

  • 1-(2-Ethoxy-2-(4'-pyridyl)ethyl)-4-(2'-methoxyphenyl)piperazine hydrochloride hemihydrate

Systematic Name

  • Piperazine, 1-(2-ethoxy-2-(4-pyridyl)ethyl)-4-(o-methoxyphenyl)-, hydrochloride, hemihydrate

Registry Numbers

CAS Registry Number

  • 77246-52-7

System Generated Number

  • 0077246527

Molecular Formulas

Molecular Formula

  • C20-H27-N3-O2.Cl-H.1/2H2-O

Molecular Formula Fragments

  • C20-H27-N3-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C20H27N3O2.ClH/c1-3-25-20(17-8-10-21-11-9-17)16-22-12-14-23(15-13-22)18-6-4-5-7-19(18)24-2;/h4-11,20H,3,12-16H2,1-2H3;1H

InChIKey

HAZSAWHMWNKEAN-UHFFFAOYSA-N

Smiles

CCOC(CN1CCN(CC1)c2ccccc2OC)c3ccncc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 103mg/kg (103mg/kg) AUTONOMIC NERVOUS SYSTEM: CENTRAL SYMPATHOLYTIC

LUNGS, THORAX, OR RESPIRATION: BRONCHIOLAR DILATION

VASCULAR: BP LOWERING NOT CHARACTERIZED IN AUTONOMIC SECTION
Bollettino Chimico Farmaceutico. Vol. 119, Pg. 608, 1980.