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Substance Name: 4-Azatricyclo(4.3.1.1(sup 3,8))undec-4-ene, 5-(2-(anilino)ethylamino)-, hydrochloride
RN: 32537-41-0
InChIKey: IJPWLZGFPVRJSY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H25-N3.Cl-H

Molecular Weight

  • 319.877
 
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Names and Synonyms

Synonyms

  • 5-(2-(Anilino)ethylamino)-4-azahomoadamant-4-ene hydrochloride
  • 5-(2-(Anilino)ethylamino)-4-azatricyclo(4.3.1.1(sup 3,8))undec-4-ene hydrochloride

Systematic Name

  • 4-Azatricyclo(4.3.1.1(sup 3,8))undec-4-ene, 5-(2-(anilino)ethylamino)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 32537-41-0

System Generated Number

  • 0032537410

Molecular Formulas

Molecular Formula

  • C18-H25-N3.Cl-H

Molecular Formula Fragments

  • C18-H25-N3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H25N3.ClH/c1-2-4-16(5-3-1)19-6-7-20-18-15-9-13-8-14(10-15)12-17(11-13)21-18;/h1-5,13-15,17,19H,6-12H2,(H,20,21);1H

InChIKey

IJPWLZGFPVRJSY-UHFFFAOYSA-N

Smiles

Cl.N=1C2C[C@@H]3C[C@@H](CC(C3)C1NCCNc1ccccc1)C2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 56mg/kg (56mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 411, 1971.
mouse LD50 oral > 1gm/kg (1000mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 411, 1971.