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Substance Name: Piperazine, 1-(4-((3-methylphenyl)methyl)-2-thiazolyl)-, sulfate, hydrate (2:1:1)
RN: 73553-68-1
InChIKey: KMHWIXYCFLTBDA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H38-N6-S2.H2-O4-S.H2-O

Molecular Weight

  • 644.882
 
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Names and Synonyms

Synonyms

  • ((Methyl-3 benzyl)-4 thiazolyl-2)-1 piperazine hemisulfate hemihydrate
  • ((Methyl-3 benzyl)-4 thiazolyl-2)-1 piperazine hemisulfate hemihydrate [French]
  • 1-(4-((3-Methylphenyl)methyl)-2-thiazolyl)piperazine sulfate hydrate (2:1:1)

Systematic Name

  • Piperazine, 1-(4-((3-methylphenyl)methyl)-2-thiazolyl)-, sulfate, hydrate (2:1:1)

Registry Numbers

CAS Registry Number

  • 73553-68-1

System Generated Number

  • 0073553681

Molecular Formulas

Molecular Formula

  • C30-H38-N6-S2.H2-O4-S.H2-O

Molecular Formula Fragments

  • C30-H38-N6-S2
  • COMPONENT
  • H2-O
  • H2-O4-S

Structure Descriptors

InChI

1S/2C15H19N3S.H2O4S/c2*1-12-3-2-4-13(9-12)10-14-11-19-15(17-14)18-7-5-16-6-8-18;1-5(2,3)4/h2*2-4,9,11,16H,5-8,10H2,1H3;(H2,1,2,3,4)

InChIKey

KMHWIXYCFLTBDA-UHFFFAOYSA-N

Smiles

Cc1cccc(c1)Cc2csc(n2)N3CCNCC3.Cc1cccc(c1)Cc2csc(n2)N3CCNCC3.OS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 250mg/kg (250mg/kg)   European Patent Application. Vol. #0005091,