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Substance Name: 1-Piperazineethanol, 4-(3-(2-chlorothioxanthen-9-yl)propyl)-, dihydrochloride
RN: 63978-46-1
InChIKey: LPWNZMIBFHMYMX-MHKBYHAFSA-N

Molecular Formula

  • C22-H27-Cl-N2-O-S.2Cl-H

Molecular Weight

  • 473.8933
 
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Names and Synonyms

Synonyms

  • N 789
  • Thioxanthene, 2-chloro-9-(3-(4-(2-hydroxyethyl)piperazinyl)propyl)-, dihydrochloride

Systematic Name

  • 1-Piperazineethanol, 4-(3-(2-chlorothioxanthen-9-yl)propyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 63978-46-1

System Generated Number

  • 0063978461

Molecular Formulas

Molecular Formula

  • C22-H27-Cl-N2-O-S.2Cl-H

Molecular Formula Fragments

  • C22-H27-Cl-N2-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25ClN2OS.2ClH/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26;;/h1-2,4-8,16,26H,3,9-15H2;2*1H/b18-5-;;

InChIKey

LPWNZMIBFHMYMX-MHKBYHAFSA-N

Smiles

c1ccc2c(c1)/C(=C/CCN3CCN(CC3)CCO)/c4cc(ccc4S2)Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 105mg/kg (105mg/kg) BEHAVIORAL: SLEEP Acta Pharmacologica et Toxicologica. Vol. 19, Pg. 87, 1962.