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Substance Name: Morpholinium, 4,4'-((1,1'-biphenyl)-4,4'-diylbis(2-oxo-2,1-ethanediyl))bis(2,4-dimethyl-, dibromide
RN: 123489-68-9
InChIKey: OEKRSOOXEYGGCG-UHFFFAOYSA-L

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C28-H38-N2-O4.2Br

Molecular Weight

  • 626.4262
 
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Names and Synonyms

Synonym

  • 4,4'-Bis((2-methyl-2,3,5,6-tetrahydro-1,4-oxazin-4-yl)acetyl)biphenyl dimethiobromide

Systematic Name

  • Morpholinium, 4,4'-((1,1'-biphenyl)-4,4'-diylbis(2-oxo-2,1-ethanediyl))bis(2,4-dimethyl-, dibromide

Registry Numbers

CAS Registry Number

  • 123489-68-9

System Generated Number

  • 0123489689

Molecular Formulas

Molecular Formula

  • C28-H38-N2-O4.2Br

Molecular Formula Fragments

  • Br
  • C28-H38-N2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C28H38N2O4.2BrH/c1-21-17-29(3,13-15-33-21)19-27(31)25-9-5-23(6-10-25)24-7-11-26(12-8-24)28(32)20-30(4)14-16-34-22(2)18-30;;/h5-12,21-22H,13-20H2,1-4H3;2*1H/q+2;;/p-2

InChIKey

OEKRSOOXEYGGCG-UHFFFAOYSA-L

Smiles

CC1C[N+](CCO1)(C)CC(=O)c2ccc(cc2)c3ccc(cc3)C(=O)C[N+]4(CCOC(C4)C)C.[Br-].[Br-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intramuscular 8144ug/kg (8.144mg/kg)   Journal of Medicinal Chemistry. Vol. 33, Pg. 577, 1990.