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Substance Name: Propiophenone, 3-(4-(beta-(isopentyloxy)phenethyl)-1-piperazinyl)-4'-methoxy-, dihydrochloride
RN: 21263-39-8
InChIKey: QVNMLYBMNOVYCR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H38-N2-O3.2Cl-H

Molecular Weight

  • 511.53
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 21263-39-8

System Generated Number

  • 0021263398

Molecular Formulas

Molecular Formula

  • C27-H38-N2-O3.2Cl-H

Molecular Formula Fragments

  • C27-H38-N2-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H38N2O3.2ClH/c1-22(2)14-20-32-27(24-7-5-4-6-8-24)21-29-18-16-28(17-19-29)15-13-26(30)23-9-11-25(31-3)12-10-23;;/h4-12,22,27H,13-21H2,1-3H3;2*1H

InChIKey

QVNMLYBMNOVYCR-UHFFFAOYSA-N

Smiles

C(=O)(c1ccc(cc1)OC)CCN1CCN(CC1)C[C@@H](c1ccccc1)OCCC(C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2005mg/kg (2005mg/kg)   United States Patent Document. Vol. #3448192,