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Substance Name: 2-Propanone, 1-(4-(2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-, (+-)-
RN: 36115-50-1
InChIKey: IYQFTMYXJCJXBY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H28-N2-O3

Molecular Weight

  • 368.474
 
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Names and Synonyms

Synonyms

  • (+-)-1-(4-(2-Hydroxy-3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-2-propanone
  • 5-23-02-00114 (Beilstein Handbook Reference)
  • BRN 0578134

Systematic Name

  • 2-Propanone, 1-(4-(2-hydroxy-3-(4-phenyl-1-piperazinyl)propoxy)phenyl)-, (+-)-

Registry Numbers

CAS Registry Number

  • 36115-50-1

System Generated Number

  • 0036115501

Structure Descriptors

InChI

1S/C22H28N2O3/c1-18(25)15-19-7-9-22(10-8-19)27-17-21(26)16-23-11-13-24(14-12-23)20-5-3-2-4-6-20/h2-10,21,26H,11-17H2,1H3

InChIKey

IYQFTMYXJCJXBY-UHFFFAOYSA-N

Smiles

C(C(C)=O)c1ccc(cc1)OC[C@@H](CN1CCN(CC1)c1ccccc1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 800mg/kg (800mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 301, 1972.