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Substance Name: 1-Piperazineethanol, 4-(3-(2-iodothioxanthen-9-ylidene)propyl)-, dihydrochloride
RN: 63978-47-2
InChIKey: XSGIUPVGODDVRD-MONHGIHASA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-I-N2-O-S.2Cl-H

Molecular Weight

  • 565.34
 
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Names and Synonyms

Synonyms

  • N 790
  • Thioxanthene, 9-(3-(4-(2-hydroxyethyl)piperazinyl)propylidene)-2-iodo-, dihydrochloride

Systematic Name

  • 1-Piperazineethanol, 4-(3-(2-iodothioxanthen-9-ylidene)propyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 63978-47-2

System Generated Number

  • 0063978472

Molecular Formulas

Molecular Formula

  • C22-H25-I-N2-O-S.2Cl-H

Molecular Formula Fragments

  • C22-H25-I-N2-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25IN2OS.2ClH/c23-17-7-8-20-18(19-4-1-2-6-21(19)27-22(20)16-17)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

XSGIUPVGODDVRD-MONHGIHASA-N

Smiles

C1(\c2c(cc(cc2)I)Sc2c1cccc2)=C\CCN1CCN(CC1)CCO.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 152mg/kg (152mg/kg) BEHAVIORAL: SLEEP Acta Pharmacologica et Toxicologica. Vol. 19, Pg. 87, 1962.