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Substance Name: 1-Piperazineethanol, 4-(4,4-diphenylbutyl)-alpha-((phenylthio)methyl)-, dihydrochloride
RN: 143760-05-8
InChIKey: UFKWSMALHTWTFH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H36-N2-O-S.2Cl-H

Molecular Weight

  • 533.6042
 
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Names and Synonyms

Synonyms

  • 1-(4,4-Diphenylbutyl)-4-(2-hydroxy-3-phenylthiopropyl)piperazine dihydrochloride
  • 4-(4,4-Diphenylbutyl)-alpha-((phenylthio)methyl)-1-piperazineethanol dihydrochloride

Systematic Name

  • 1-Piperazineethanol, 4-(4,4-diphenylbutyl)-alpha-((phenylthio)methyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 143760-05-8

System Generated Number

  • 0143760058

Molecular Formulas

Molecular Formula

  • C29-H36-N2-O-S.2Cl-H

Molecular Formula Fragments

  • C29-H36-N2-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C29H36N2OS.2ClH/c32-27(24-33-28-15-8-3-9-16-28)23-31-21-19-30(20-22-31)18-10-17-29(25-11-4-1-5-12-25)26-13-6-2-7-14-26;;/h1-9,11-16,27,29,32H,10,17-24H2;2*1H

InChIKey

UFKWSMALHTWTFH-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C(CCCN2CCN(CC2)CC(CSc3ccccc3)O)c4ccccc4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #5391552,