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Substance Name: Piperazine, 1-(3,3,3-triphenylpropyl)-4-(2-thiazolyl)-, dimethanesulfonate
RN: 36524-83-1
InChIKey: FASRCBZJGUBERH-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H29-N3-S.2C-H4-O3-S

Molecular Weight

  • 631.835
 
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Names and Synonyms

Synonym

  • 1-(3,3,3-Triphenylpropyl)-4-(2-thiazolyl)piperazine dimethanesulfonate

Systematic Name

  • Piperazine, 1-(3,3,3-triphenylpropyl)-4-(2-thiazolyl)-, dimethanesulfonate

Registry Numbers

CAS Registry Number

  • 36524-83-1

System Generated Number

  • 0036524831

Molecular Formulas

Molecular Formula

  • C28-H29-N3-S.2C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C28-H29-N3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C28H29N3S.2CH4O3S/c1-4-10-24(11-5-1)28(25-12-6-2-7-13-25,26-14-8-3-9-15-26)16-18-30-19-21-31(22-20-30)27-29-17-23-32-27;2*1-5(2,3)4/h1-15,17,23H,16,18-22H2;2*1H3,(H,2,3,4)

InChIKey

FASRCBZJGUBERH-UHFFFAOYSA-N

Smiles

c1(N2CCN(CC2)CCC(c2ccccc2)(c2ccccc2)c2ccccc2)nccs1.S(=O)(=O)(O)C.S(=O)(=O)(O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 450mg/kg (450mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 295, 1972.