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Substance Name: Penten-3-ol, 5-(4-(p-methoxyphenyl)piperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride
RN: 37151-54-5
InChIKey: ZFULPIWVZQAEGU-RMZRELHQSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H34-N2-O5.2Cl-H

Molecular Weight

  • 515.474
 
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Names and Synonyms

Synonym

  • 1-Piperazinepropanol, 4-(p-methoxyphenyl)-alpha-(3,4,5-trimethoxystyryl)-, dihydrochloride

Systematic Name

  • Penten-3-ol, 5-(4-(p-methoxyphenyl)piperazinyl)-1-(3,4,5-trimethoxyphenyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 37151-54-5

System Generated Number

  • 0037151545

Molecular Formulas

Molecular Formula

  • C25-H34-N2-O5.2Cl-H

Molecular Formula Fragments

  • C25-H34-N2-O5
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H34N2O5.2ClH/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;;/h5-10,17-18,21,28H,11-16H2,1-4H3;2*1H/b8-5+;;

InChIKey

ZFULPIWVZQAEGU-RMZRELHQSA-N

Smiles

N1(CCN(CC1)c1ccc(cc1)OC)CC[C@@H](O)\C=C\c1cc(c(c(c1)OC)OC)OC.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.