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Substance Name: Propiophenone, 2',4'-dimethoxy-3-(4-(beta-isobutoxyphenethyl)-1-piperazinyl)-, dihydrochloride
RN: 21263-35-4
InChIKey: GDSCMQMDMGDXOS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H38-N2-O4.2Cl-H

Molecular Weight

  • 527.529
 
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Names and Synonyms

Synonym

  • 2',4'-Dimethoxy-3-(4-(beta-isobutoxyphenethyl)-1-piperazinyl)propiophenone dihydrochloride

Systematic Name

  • Propiophenone, 2',4'-dimethoxy-3-(4-(beta-isobutoxyphenethyl)-1-piperazinyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 21263-35-4

System Generated Number

  • 0021263354

Molecular Formulas

Molecular Formula

  • C27-H38-N2-O4.2Cl-H

Molecular Formula Fragments

  • C27-H38-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H38N2O4.2ClH/c1-27(2,3)33-26(19-21-9-7-6-8-10-21)29-17-15-28(16-18-29)14-13-24(30)23-12-11-22(31-4)20-25(23)32-5;;/h6-12,20,26H,13-19H2,1-5H3;2*1H

InChIKey

GDSCMQMDMGDXOS-UHFFFAOYSA-N

Smiles

C(=O)(c1c(cc(cc1)OC)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 500mg/kg (500mg/kg)   United States Patent Document. Vol. #3448192,