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Substance Name: 3,8-Diazabicyclo(3.2.1)octane, 3-(4-phenyl-3-butenyl)-8-propionyl-, hydrochloride
RN: 1507-84-2
InChIKey: OEJMBQJRNMMBCC-AAGWESIMSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H26-N2-O.Cl-H

Molecular Weight

  • 334.888
 
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Names and Synonyms

Synonym

  • 3-(4-Phenyl-3-butenyl)-8-propionyl-3,8-diazabicyclo(3.2.1)octane

Systematic Name

  • 3,8-Diazabicyclo(3.2.1)octane, 3-(4-phenyl-3-butenyl)-8-propionyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 1507-84-2

System Generated Number

  • 0001507842

Molecular Formulas

Molecular Formula

  • C19-H26-N2-O.Cl-H

Molecular Formula Fragments

  • C19-H26-N2-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H26N2O.ClH/c1-2-19(22)21-17-11-12-18(21)15-20(14-17)13-7-6-10-16-8-4-3-5-9-16;/h3-6,8-10,17-18H,2,7,11-15H2,1H3;1H/b10-6+;

InChIKey

OEJMBQJRNMMBCC-AAGWESIMSA-N

Smiles

C1[C@@H]2CC[C@@H](CN1CC\C=C\c1ccccc1)N2C(=O)CC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 326, 1965.