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Substance Name: 1-Piperazineethanol, 4-(2-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-, monomethanesulfonate (salt)
RN: 62832-93-3
InChIKey: ASYRLXUSPHBRLD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H28-N4-O2.C-H4-O3-S

Molecular Weight

  • 488.6058
 
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Names and Synonyms

  • 1-Piperazineethanol, 4-(2-((1,4-diphenyl-1H-pyrazol-3-yl)oxy)ethyl)-, monomethanesulfonate (salt)

Registry Numbers

CAS Registry Number

  • 62832-93-3

System Generated Number

  • 0062832933

Molecular Formulas

Molecular Formula

  • C23-H28-N4-O2.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C23-H28-N4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C23H28N4O2.CH4O3S/c28-17-15-25-11-13-26(14-12-25)16-18-29-23-22(20-7-3-1-4-8-20)19-27(24-23)21-9-5-2-6-10-21;1-5(2,3)4/h1-10,19,28H,11-18H2;1H3,(H,2,3,4)

InChIKey

ASYRLXUSPHBRLD-UHFFFAOYSA-N

Smiles

CS(=O)(=O)O.c1ccc(cc1)c2cn(nc2OCCN3CCN(CC3)CCO)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 intravenous 80mg/kg (80mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 oral > 1gm/kg (1000mg/kg)   French Demande Patent Document. Vol. #2301250,