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Substance Name: Propiophenone, 3-(4-(beta-isobutoxyphenethyl)-1-piperazinyl)-, dihydrochloride
RN: 21263-32-1
InChIKey: LGYHPWSSAZQBQC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H34-N2-O2.2Cl-H

Molecular Weight

  • 467.477
 
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Names and Synonyms

Synonym

  • 3-(4-(beta-Isobutoxyphenethyl)-1-piperazinyl)propiophenone dihydrochloride

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 21263-32-1

System Generated Number

  • 0021263321

Molecular Formulas

Molecular Formula

  • C25-H34-N2-O2.2Cl-H

Molecular Formula Fragments

  • C25-H34-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H34N2O2.2ClH/c1-25(2,3)29-24(20-21-10-6-4-7-11-21)27-18-16-26(17-19-27)15-14-23(28)22-12-8-5-9-13-22;;/h4-13,24H,14-20H2,1-3H3;2*1H

InChIKey

LGYHPWSSAZQBQC-UHFFFAOYSA-N

Smiles

C(=O)(c1ccccc1)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 500mg/kg (500mg/kg)   United States Patent Document. Vol. #3448192,