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Substance Name: Isoquinoline, 1,2,3,4-tetrahydro-3-benzylimino-6,7-dimethoxy-1-phenyl-, hydrochloride, hydrate (2:2:1)
RN: 78915-27-2
InChIKey: CLJRHKINOKFUBV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H24-N2-O2.Cl-H.1/2H2-O

Molecular Weight

  • 408.9265
 
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Names and Synonyms

Synonyms

  • 1,2,3,4-Tetrahydro-3-benzylimino-6,7-dimethoxy-1-phenylisoquinoline HCl hemihydrate
  • 3-Benzylimino-6,7-dimethoxy-1-phenyl-1,2,3,4-tetrahydroisoquinoline HCl hemihydrate
  • 3-Isoquinolinamine, 1,4-dihydro-6,7-dimethoxy-1-phenyl-N-(phenylmethyl)-, monohydrochloride

Systematic Name

  • Isoquinoline, 1,2,3,4-tetrahydro-3-benzylimino-6,7-dimethoxy-1-phenyl-, hydrochloride, hydrate (2:2:1)

Registry Numbers

CAS Registry Number

  • 78915-27-2

System Generated Number

  • 0078915272

Molecular Formulas

Molecular Formula

  • C24-H24-N2-O2.Cl-H.1/2H2-O

Molecular Formula Fragments

  • C24-H24-N2-O2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C24H24N2O2.ClH/c1-27-21-13-19-14-23(25-16-17-9-5-3-6-10-17)26-24(18-11-7-4-8-12-18)20(19)15-22(21)28-2;/h3-13,15,24H,14,16H2,1-2H3,(H,25,26);1H

InChIKey

CLJRHKINOKFUBV-UHFFFAOYSA-N

Smiles

COc1cc2c(cc1OC)C(N=C(C2)NCc3ccccc3)c4ccccc4.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 144mg/kg (144mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)

BEHAVIORAL: TREMOR
Pharmaceutical Chemistry Journal Vol. 15, Pg. 324, 1981.