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Substance Name: 1H-Pyrazole, 1,4-diphenyl-3-(3-(1-pyrrolidinyl)propoxy)-, monomethanesulfonate
RN: 62833-04-9
InChIKey: MGASCQKTKMCKLU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H25-N3-O.C-H4-O3-S

Molecular Weight

  • 443.5651
 
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Names and Synonyms

Synonym

  • 1,4-Diphenyl-3-(3-(1-pyrrolidinyl)propoxy)-1H-pyrazole monomethanesulfonate

Systematic Name

  • 1H-Pyrazole, 1,4-diphenyl-3-(3-(1-pyrrolidinyl)propoxy)-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 62833-04-9

System Generated Number

  • 0062833049

Molecular Formulas

Molecular Formula

  • C22-H25-N3-O.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C22-H25-N3-O
  • COMPONENT

Structure Descriptors

InChI

1S/C22H25N3O.CH4O3S/c1-3-10-19(11-4-1)21-18-25(20-12-5-2-6-13-20)23-22(21)26-17-9-16-24-14-7-8-15-24;1-5(2,3)4/h1-6,10-13,18H,7-9,14-17H2;1H3,(H,2,3,4)

InChIKey

MGASCQKTKMCKLU-UHFFFAOYSA-N

Smiles

CS(=O)(=O)O.c1ccc(cc1)c2cn(nc2OCCCN3CCCC3)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 intravenous 35mg/kg (35mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 oral 1gm/kg (1000mg/kg)   French Demande Patent Document. Vol. #2301250,