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Substance Name: 5H-Dibenz(b,f)azepine, 5-(2-(4-methyl-1-piperazinyl)acetyl)-, dihydrochloride
RN: 118989-88-1
InChIKey: IIAUTSWBXOKZFC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H23-N3-O.2Cl-H

Molecular Weight

  • 406.3545
 
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Names and Synonyms

Synonym

  • 5-(2-(4-Methyl-1-piperazinyl)acetyl)-5H-dibenz(b,f)azepine dihydrochloride

Systematic Name

  • 5H-Dibenz(b,f)azepine, 5-(2-(4-methyl-1-piperazinyl)acetyl)-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 118989-88-1

System Generated Number

  • 0118989881

Molecular Formulas

Molecular Formula

  • C21-H23-N3-O.2Cl-H

Molecular Formula Fragments

  • C21-H23-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H23N3O.2ClH/c1-22-12-14-23(15-13-22)16-21(25)24-19-8-4-2-6-17(19)10-11-18-7-3-5-9-20(18)24;;/h2-11H,12-16H2,1H3;2*1H

InChIKey

IIAUTSWBXOKZFC-UHFFFAOYSA-N

Smiles

CN1CCN(CC1)CC(=O)N2c3ccccc3C=Cc4c2cccc4.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1131mg/kg (1131mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 1820, 1988.