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Substance Name: 1-Phenyl-1-(2',5'-dimethoxyphenyl)-3-piperidinobutanol
RN: 858-68-4
InChIKey: KNMNJRKLCVISHT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H31-N-O3.Cl-H

Molecular Weight

  • 405.963
 
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Names and Synonyms

Name of Substance

  • 1-Phenyl-1-(2',5'-dimethoxyphenyl)-3-piperidinobutanol

Synonyms

  • alpha-(2,5-Dimethoxyphenyl)-gamma-methyl-alpha-phenyl-1-piperidinepropanol hydrochloride
  • YS 3635

Systematic Name

  • 1-Piperidinepropanol, alpha-(2,5-dimethoxyphenyl)-gamma-methyl-alpha-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 858-68-4

System Generated Number

  • 0000858684

Molecular Formulas

Molecular Formula

  • C23-H31-N-O3.Cl-H

Molecular Formula Fragments

  • C23-H31-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H31NO3.ClH/c1-18(24-14-8-5-9-15-24)17-23(25,19-10-6-4-7-11-19)21-16-20(26-2)12-13-22(21)27-3;/h4,6-7,10-13,16,18,25H,5,8-9,14-15,17H2,1-3H3;1H

InChIKey

KNMNJRKLCVISHT-UHFFFAOYSA-N

Smiles

c1c(cc([C@@](O)(c2ccccc2)C[C@@H](C)N2CCCCC2)c(c1)OC)OC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 135mg/kg (135mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Arzneimittel-Forschung. Drug Research. Vol. 15, Pg. 1279, 1965.
mouse LD50 intravenous 46mg/kg (46mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Arzneimittel-Forschung. Drug Research. Vol. 15, Pg. 1279, 1965.
mouse LD50 oral 355mg/kg (355mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: TREMOR
Arzneimittel-Forschung. Drug Research. Vol. 15, Pg. 1279, 1965.