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Substance Name: Propiophenone, 4'-chloro-3-(4-(beta-(isopentyloxy)phenethyl)-1-piperazinyl)-2-methyl-, dihydrochloride
RN: 21263-17-2
InChIKey: DSSRZPARRDWWJV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H37-Cl-N2-O2.2Cl-H

Molecular Weight

  • 529.976
 
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Names and Synonyms

  • Propiophenone, 4'-chloro-3-(4-(beta-(isopentyloxy)phenethyl)-1-piperazinyl)-2-methyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 21263-17-2

System Generated Number

  • 0021263172

Molecular Formulas

Molecular Formula

  • C27-H37-Cl-N2-O2.2Cl-H

Molecular Formula Fragments

  • C27-H37-Cl-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C27H37ClN2O2.2ClH/c1-21(2)13-18-32-26(23-7-5-4-6-8-23)20-30-16-14-29(15-17-30)19-22(3)27(31)24-9-11-25(28)12-10-24;;/h4-12,21-22,26H,13-20H2,1-3H3;2*1H

InChIKey

DSSRZPARRDWWJV-UHFFFAOYSA-N

Smiles

C(=O)(c1ccc(cc1)Cl)[C@@H](C)CN1CCN(CC1)C[C@@H](c1ccccc1)OCCC(C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #3448192,