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Substance Name: Piperazine, 1-(3-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)propyl)-4-methyl-, dimethanesulfonate
RN: 62833-08-3
InChIKey: XFIXVINZCOIIKW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H28-N4-O.2C-H4-O3-S

Molecular Weight

  • 568.7124
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 62833-08-3

System Generated Number

  • 0062833083

Molecular Formulas

Molecular Formula

  • C23-H28-N4-O.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C23-H28-N4-O
  • COMPONENT

Structure Descriptors

InChI

1S/C23H28N4O.2CH4O3S/c1-25-14-16-26(17-15-25)13-8-18-28-23-22(20-9-4-2-5-10-20)19-27(24-23)21-11-6-3-7-12-21;2*1-5(2,3)4/h2-7,9-12,19H,8,13-18H2,1H3;2*1H3,(H,2,3,4)

InChIKey

XFIXVINZCOIIKW-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)CCCOc2c(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 160mg/kg (160mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 intravenous 65mg/kg (65mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 oral 750mg/kg (750mg/kg)   French Demande Patent Document. Vol. #2301250,