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Substance Name: 1,4-Cyclohexanebis(methylamine), N,N'-bis(4-dimethylaminobenzyl)-, tetrahydrochloride
RN: 1254-80-4
InChIKey: QXMJKFZFEVGIQU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H40-N4.4Cl-H

Molecular Weight

  • 554.474
 
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Names and Synonyms

Synonyms

  • Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(4-dimethylamino-, tetrahydrochloride
  • N,N'-(1,4-Cyclohexylenedimethylene)bis(4-dimethylaminobenzylamine) tetrahydrochloride
  • N,N'-Bis(4-dimethylaminobenzyl)-1,4-cyclohexanebis(methylamine) tetrahydrochloride

Systematic Name

  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(4-dimethylaminobenzyl)-, tetrahydrochloride

Registry Numbers

CAS Registry Number

  • 1254-80-4

System Generated Number

  • 0001254804

Molecular Formulas

Molecular Formula

  • C26-H40-N4.4Cl-H

Molecular Formula Fragments

  • C26-H40-N4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H40N4.4ClH/c1-29(2)25-13-9-23(10-14-25)19-27-17-21-5-7-22(8-6-21)18-28-20-24-11-15-26(16-12-24)30(3)4;;;;/h9-16,21-22,27-28H,5-8,17-20H2,1-4H3;4*1H

InChIKey

QXMJKFZFEVGIQU-UHFFFAOYSA-N

Smiles

c1(N(C)C)ccc(cc1)CNCC1CCC(CC1)CNCc1ccc(cc1)N(C)C.Cl.Cl.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 162mg/kg (162mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 329, 1966.