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Substance Name: Propiophenone, 3-(4-(beta-isobutoxyphenethyl)-1-piperazinyl)-4'-methoxy-, dihydrochloride
RN: 22261-66-1
InChIKey: DSLZTLJLUNJVHQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H36-N2-O3.2Cl-H

Molecular Weight

  • 497.503
 
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Names and Synonyms

Synonym

  • 3-(4-(beta-Isobutoxyphenethyl)-1-piperazinyl)-4'-methoxypropiophenone dihydrochloride

Systematic Name

  • Propiophenone, 3-(4-(beta-isobutoxyphenethyl)-1-piperazinyl)-4'-methoxy-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 22261-66-1

System Generated Number

  • 0022261661

Molecular Formulas

Molecular Formula

  • C26-H36-N2-O3.2Cl-H

Molecular Formula Fragments

  • C26-H36-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H36N2O3.2ClH/c1-26(2,3)31-25(20-21-8-6-5-7-9-21)28-18-16-27(17-19-28)15-14-24(29)22-10-12-23(30-4)13-11-22;;/h5-13,25H,14-20H2,1-4H3;2*1H

InChIKey

DSLZTLJLUNJVHQ-UHFFFAOYSA-N

Smiles

C(=O)(c1ccc(cc1)OC)CCN1CCN(CC1)[C@@H](Cc1ccccc1)OC(C)(C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 406mg/kg (406mg/kg)   United States Patent Document. Vol. #3448192,