Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Piperazine, 1-(2-chloro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate
RN: 58722-76-2
InChIKey: NCRDWAQSUUCYPO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H18-Cl-F-N2-S.C-H4-O3-S

Molecular Weight

  • 456.9878
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 1-(2-Chloro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methylpiperazine monomethanesulfonate
  • 2-Chloro-7-fluoro-10-(4-methylpiperazino)dibenzo(b,f)thiepin methanesulfonate

Systematic Name

  • Piperazine, 1-(2-chloro-7-fluorodibenzo(b,f)thiepin-10-yl)-4-methyl-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 58722-76-2

System Generated Number

  • 0058722762

Molecular Formulas

Molecular Formula

  • C19-H18-Cl-F-N2-S.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C19-H18-Cl-F-N2-S
  • COMPONENT

Structure Descriptors

InChI

1S/C19H18ClFN2S.CH4O3S/c1-22-6-8-23(9-7-22)17-11-13-10-14(20)2-5-18(13)24-19-12-15(21)3-4-16(17)19;1-5(2,3)4/h2-5,10-12H,6-9H2,1H3;1H3,(H,2,3,4)

InChIKey

NCRDWAQSUUCYPO-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)C2=Cc3cc(ccc3Sc4c2ccc(c4)F)Cl.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 342mg/kg (342mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

BEHAVIORAL: REGIDITY

BEHAVIORAL: ATAXIA
Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 2887, 1975.