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Substance Name: Piperazine, 1-(8-chloro-10,11-dihydro-2,3-dimethoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, dimethanesulfonate
RN: 60969-81-5
InChIKey: OZVZCNXOYLMSJO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H25-Cl-N2-O2-S.2C-H4-O3-S

Molecular Weight

  • 597.1707
 
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Names and Synonyms

  • Piperazine, 1-(8-chloro-10,11-dihydro-2,3-dimethoxydibenzo(b,f)thiepin-10-yl)-4-methyl-, dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 60969-81-5

System Generated Number

  • 0060969815

Molecular Formulas

Molecular Formula

  • C21-H25-Cl-N2-O2-S.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C21-H25-Cl-N2-O2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C21H25ClN2O2S.2CH4O3S/c1-23-6-8-24(9-7-23)17-10-14-11-18(25-2)19(26-3)13-21(14)27-20-5-4-15(22)12-16(17)20;2*1-5(2,3)4/h4-5,11-13,17H,6-10H2,1-3H3;2*1H3,(H,2,3,4)

InChIKey

OZVZCNXOYLMSJO-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)C2Cc3cc(c(cc3Sc4c2cc(cc4)Cl)OC)OC.CS(=O)(=O)O.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 640mg/kg (640mg/kg) BEHAVIORAL: ATAXIA Collection of Czechoslovak Chemical Communications. Vol. 41, Pg. 1396, 1976.