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Substance Name: Penten-3-one, 5-(4-(p-methoxyphenyl)piperazinyl)-1-(3,4,5-trimethoxyphenyl)-, hydrobromide
RN: 37399-58-9
InChIKey: KCMDIHWIVFNRSU-HAAWTFQLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H32-N2-O5.Br-H

Molecular Weight

  • 521.4487
 
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Names and Synonyms

Synonyms

  • Piperazine, 1-(p-methoxyphenyl)-4-(2-(3,4,5-trimethoxycinnamoyl)ethyl)-, hydrobromide
  • Piperazine, 1-p-anisyl-4-(2-(3,4,5-trimethoxycinnamoyl)ethyl)-, hydrobromide

Systematic Name

  • Penten-3-one, 5-(4-(p-methoxyphenyl)piperazinyl)-1-(3,4,5-trimethoxyphenyl)-, hydrobromide

Registry Numbers

CAS Registry Number

  • 37399-58-9

System Generated Number

  • 0037399589

Molecular Formulas

Molecular Formula

  • C25-H32-N2-O5.Br-H

Molecular Formula Fragments

  • Br-H
  • C25-H32-N2-O5
  • COMPONENT

Structure Descriptors

InChI

1S/C25H32N2O5.BrH/c1-29-22-9-6-20(7-10-22)27-15-13-26(14-16-27)12-11-21(28)8-5-19-17-23(30-2)25(32-4)24(18-19)31-3;/h5-10,17-18H,11-16H2,1-4H3;1H/b8-5+;

InChIKey

KCMDIHWIVFNRSU-HAAWTFQLSA-N

Smiles

COc1ccc(cc1)N2CCN(CC2)CCC(=O)/C=C/c3cc(c(c(c3)OC)OC)OC.Br

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. 417, 1972.