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Substance Name: VUFB-10683
RN: 63186-53-8
InChIKey: LHIRDEFYNBWVAQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H23-Cl-N2-O2-S.2Cl-H

Molecular Weight

  • 463.8545
 
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Names and Synonyms

Results Name

  • VUFB-10683

Synonyms

  • 2-Chloro-8-hydroxy-10-(4-(2-hydroxyethyl)piperazino)-10,11-dihydrodibenzo(b,f)thiepin 2HCl
  • VUFB-10683

Systematic Name

  • 1-Piperazineethanol, 4-(2-chloro-10,11-dihydro-8-hydroxydibenzo(b,f)thiepin-10-yl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 63186-53-8

System Generated Number

  • 0063186538

Molecular Formulas

Molecular Formula

  • C20-H23-Cl-N2-O2-S.2Cl-H

Molecular Formula Fragments

  • C20-H23-Cl-N2-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H23ClN2O2S.2ClH/c21-15-1-3-19-14(11-15)12-18(17-13-16(25)2-4-20(17)26-19)23-7-5-22(6-8-23)9-10-24;;/h1-4,11,13,18,24-25H,5-10,12H2;2*1H

InChIKey

LHIRDEFYNBWVAQ-UHFFFAOYSA-N

Smiles

c1cc2c(cc1O)C(Cc3cc(ccc3S2)Cl)N4CCN(CC4)CCO.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 94900ug/kg (94.9mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 3607, 1976.