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Substance Name: 1-Propanamine, 3-((4-(4-methoxyphenyl)-1-(4-methylphenyl)-1H-pyrazol-3-yl)oxy)-N,N-dimethyl-,monomethanesulfonate
RN: 62832-56-8
InChIKey: UAIBYLDBRZYLSO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H27-N3-O2.C-H4-O3-S

Molecular Weight

  • 461.5799
 
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Names and Synonyms

  • 1-Propanamine, 3-((4-(4-methoxyphenyl)-1-(4-methylphenyl)-1H-pyrazol-3-yl)oxy)-N,N-dimethyl-,monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 62832-56-8

System Generated Number

  • 0062832568

Molecular Formulas

Molecular Formula

  • C22-H27-N3-O2.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C22-H27-N3-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C22H27N3O2.CH4O3S/c1-17-6-10-19(11-7-17)25-16-21(18-8-12-20(26-4)13-9-18)22(23-25)27-15-5-14-24(2)3;1-5(2,3)4/h6-13,16H,5,14-15H2,1-4H3;1H3,(H,2,3,4)

InChIKey

UAIBYLDBRZYLSO-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)n2cc(c(n2)OCCCN(C)C)c3ccc(cc3)OC.CS(=O)(=O)O

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 35mg/kg (35mg/kg)   French Demande Patent Document. Vol. #2301250,
mouse LD50 oral 1gm/kg (1000mg/kg)   French Demande Patent Document. Vol. #2301250,