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Substance Name: 1-Piperazinepropanol, beta-benzyl-alpha-ethyl-4-methyl-alpha-phenyl-, methiodide
RN: 72050-86-3
InChIKey: HNDBAZOOQBTBHD-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H32-N2-O.C-H3-I

Molecular Weight

  • 636.3882
 
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Names and Synonyms

Synonyms

  • 1-Propanol, 1,3-diphenyl-1-ethyl-2-(4-methyl-1-piperazinylmethyl)-, methiodide
  • beta-Benzyl-alpha-ethyl-4-methyl-alpha-phenyl-1-piperazinepropanol methiodide
  • Piperazinium, 1-(2-benzyl-3-hydroxy-3-phenylpentyl)-1,4,4-trimethyl-, diiodide

Systematic Name

  • 1-Piperazinepropanol, beta-benzyl-alpha-ethyl-4-methyl-alpha-phenyl-, methiodide

Registry Numbers

CAS Registry Number

  • 72050-86-3

System Generated Number

  • 0072050863

Molecular Formulas

Molecular Formula

  • C23-H32-N2-O.C-H3-I

Molecular Formula Fragments

  • C-H3-I
  • C23-H32-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C25H38N2O.2HI/c1-5-25(28,23-14-10-7-11-15-23)24(20-22-12-8-6-9-13-22)21-27(4)18-16-26(2,3)17-19-27;;/h6-15,24,28H,5,16-21H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

HNDBAZOOQBTBHD-UHFFFAOYSA-L

Smiles

CCC(c1ccccc1)(C(Cc2ccccc2)C[N+]3(CC[N+](CC3)(C)C)C)O.[I-].[I-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1750mg/kg (1750mg/kg)   Chimica Therapeutica. Vol. 7, Pg. 293, 1972.