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Substance Name: Acetophenone, 2'-((2-hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)-, dihydrochloride
RN: 63990-78-3
InChIKey: BXXVTBZNDMLJMK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N2-O4.2Cl-H

Molecular Weight

  • 457.395
 
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Names and Synonyms

Synonym

  • 2'-((2-Hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)acetophenone dihydrochloride

Systematic Name

  • Acetophenone, 2'-((2-hydroxy-3-(4-(o-methoxyphenyl)piperazinyl))propoxy)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 63990-78-3

System Generated Number

  • 0063990783

Molecular Formulas

Molecular Formula

  • C22-H28-N2-O4.2Cl-H

Molecular Formula Fragments

  • C22-H28-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H28N2O4.2ClH/c1-17(25)19-7-3-5-9-21(19)28-16-18(26)15-23-11-13-24(14-12-23)20-8-4-6-10-22(20)27-2;;/h3-10,18,26H,11-16H2,1-2H3;2*1H

InChIKey

BXXVTBZNDMLJMK-UHFFFAOYSA-N

Smiles

N1(c2c(OC)cccc2)CCN(C[C@@H](COc2c(C(=O)C)cccc2)O)CC1.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 175mg/kg (175mg/kg)   Journal of Medicinal Chemistry. Vol. 16, Pg. 797, 1973.