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Substance Name: Theophylline, 8-(1-ethyl-4-piperidyl)-, hydrochloride
RN: 97361-19-8
InChIKey: IMZVVHCHRKENSX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N5-O2.x-Cl-H

Molecular Weight

  • 327.8138
 
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Names and Synonyms

Synonyms

  • 8-(1-Ethyl-4-piperidyl)theophylline hydrochloride
  • Chlorhydrate N ethyl piperidyl-4' theophylline
  • Chlorhydrate N ethyl piperidyl-4' theophylline [French]

Systematic Name

  • Theophylline, 8-(1-ethyl-4-piperidyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 97361-19-8

System Generated Number

  • 0097361198

Molecular Formulas

Molecular Formula

  • C14-H21-N5-O2.x-Cl-H

Molecular Formula Fragments

  • C14-H21-N5-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H21N5O2.ClH/c1-4-19-7-5-9(6-8-19)11-15-10-12(16-11)17(2)14(21)18(3)13(10)20;/h9H,4-8H2,1-3H3,(H,15,16);1H

InChIKey

IMZVVHCHRKENSX-UHFFFAOYSA-N

Smiles

CCN1CCC(CC1)c2[nH]c3c(n2)n(c(=O)n(c3=O)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 39mg/kg (39mg/kg) BEHAVIORAL: SLEEP

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Annales Pharmaceutiques Francaises. Vol. 22, Pg. 265, 1964.
mouse LD50 subcutaneous 450mg/kg (450mg/kg)   Annales Pharmaceutiques Francaises. Vol. 22, Pg. 265, 1964.