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Substance Name: Piperazine, 1-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-phenoxyethyl)-, maleate (1:1)
RN: 101040-99-7
InChIKey: RDBGKRRVSVLZIL-WLHGVMLRSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H27-C1-N2-O-S.C4-H4-O4

Molecular Weight

  • 567.1029
 
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Names and Synonyms

Synonyms

  • 1-(2-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-phenoxyethyl)piperazine
  • 1-(2-Chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-phenoxyethyl)piperazine maleate

Systematic Name

  • Piperazine, 1-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-4-(2-phenoxyethyl)-, maleate (1:1)

Registry Numbers

CAS Registry Number

  • 101040-99-7

System Generated Number

  • 0101040997

Molecular Formulas

Molecular Formula

  • C26-H27-C1-N2-O-S.C4-H4-O4

Molecular Formula Fragments

  • C26-H27-C1-N2-O-S
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C26H27ClN2OS.C4H4O4/c27-21-10-11-25-20(18-21)19-24(23-8-4-5-9-26(23)31-25)29-14-12-28(13-15-29)16-17-30-22-6-2-1-3-7-22;5-3(6)1-2-4(7)8/h1-11,18,24H,12-17,19H2;1-2H,(H,5,6)(H,7,8)/b;2-1+

InChIKey

RDBGKRRVSVLZIL-WLHGVMLRSA-N

Smiles

c1ccc(cc1)OCCN2CCN(CC2)C3Cc4cc(ccc4Sc5c3cccc5)Cl.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 35mg/kg (35mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 50, Pg. 1070, 1985.
mouse LD50 oral 981mg/kg (981mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 50, Pg. 1070, 1985.