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Substance Name: Barbituric acid, 5-allyl-1-benzyl-3-(2-piperidinoethyl)-5-isopropyl-, hydrobromide
RN: 78109-68-9
InChIKey: OTIBKFDPUXZTBX-UHFFFAOYSA-N

Molecular Formula

  • C24-H33-N3-O3.Br-H

Molecular Weight

  • 492.455
 
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Names and Synonyms

Synonym

  • BB 40

Systematic Name

  • Barbituric acid, 5-allyl-1-benzyl-3-(2-piperidinoethyl)-5-isopropyl-, hydrobromide

Registry Numbers

CAS Registry Number

  • 78109-68-9

System Generated Number

  • 0078109689

Molecular Formulas

Molecular Formula

  • C24-H33-N3-O3.Br-H

Molecular Formula Fragments

  • Br-H
  • C24-H33-N3-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C24H33N3O3.BrH/c1-4-13-24(19(2)3)21(28)26(17-16-25-14-9-6-10-15-25)23(30)27(22(24)29)18-20-11-7-5-8-12-20;/h4-5,7-8,11-12,19H,1,6,9-10,13-18H2,2-3H3;1H

InChIKey

OTIBKFDPUXZTBX-UHFFFAOYSA-N

Smiles

C1([C@@](C(N(CC[NH+]2CCCCC2)C(N1Cc1ccccc1)=O)=O)(CC=C)C(C)C)=O.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 460mg/kg (460mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

CARDIAC: ARRHYTHMIAS (INCLUDING CHANGES IN CONDUCTION)
Arzneimittel-Forschung. Drug Research. Vol. 13, Pg. 530, 1963.