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Substance Name: Penten-3-one, 5-(4-cyclohexylpiperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride
RN: 37151-43-2
InChIKey: SVQPFJPZAKQLCE-TTWKNDKESA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H36-N2-O4.2Cl-H

Molecular Weight

  • 489.48
 
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Names and Synonyms

Synonym

  • Piperazine, 1-cyclohexyl-4-(2-(3,4,5-trimethoxycinnamoyl)ethyl)-, dihydrochloride

Systematic Name

  • Penten-3-one, 5-(4-cyclohexylpiperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 37151-43-2

System Generated Number

  • 0037151432

Molecular Formulas

Molecular Formula

  • C24-H36-N2-O4.2Cl-H

Molecular Formula Fragments

  • C24-H36-N2-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H36N2O4.2ClH/c1-28-22-17-19(18-23(29-2)24(22)30-3)9-10-21(27)11-12-25-13-15-26(16-14-25)20-7-5-4-6-8-20;;/h9-10,17-18,20H,4-8,11-16H2,1-3H3;2*1H/b10-9+;;

InChIKey

SVQPFJPZAKQLCE-TTWKNDKESA-N

Smiles

C(\c1cc(c(c(c1)OC)OC)OC)=C\C(CCN1CCN(CC1)C1CCCCC1)=O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 417, 1972.