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Substance Name: Piperazine, 1-(2-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-4-methyl-, dimethanesulfonate
RN: 62832-91-1
InChIKey: JHGCONPKKHFLNR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H26-N4-O.2C-H4-O3-S

Molecular Weight

  • 554.6856
 
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Names and Synonyms

Synonym

  • 1-(2-((1,4-Diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-4-methylpiperazine dimethanesulfonate

Systematic Name

  • Piperazine, 1-(2-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-4-methyl-, dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 62832-91-1

System Generated Number

  • 0062832911

Molecular Formulas

Molecular Formula

  • C22-H26-N4-O.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C22-H26-N4-O
  • COMPONENT

Structure Descriptors

InChI

1S/C22H26N4O.2CH4O3S/c1-24-12-14-25(15-13-24)16-17-27-22-21(19-8-4-2-5-9-19)18-26(23-22)20-10-6-3-7-11-20;2*1-5(2,3)4/h2-11,18H,12-17H2,1H3;2*1H3,(H,2,3,4)

InChIKey

JHGCONPKKHFLNR-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)CCOc2c(cn(n2)c3ccccc3)c4ccccc4.CS(=O)(=O)O.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 225mg/kg (225mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 intravenous 65mg/kg (65mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 oral > 1gm/kg (1000mg/kg)   French Demande Patent Document. Vol. #2301250,