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Substance Name: AY-9944
RN: 366-93-8
InChIKey: NRVIEWRSGDDWHP-PMXFUEHMSA-N

Note

  • An anti-cholesteremic agent that inhibits delta 7-reductase, delta 14 reductase, and sterol biosynthesis.

Molecular Formula

  • C22-H28-Cl2-N2.2Cl-H

Molecular Weight

  • 464.305
 

Classification Codes

  • Anticholesteremic Agents
  • Antimetabolites
  • Drug / Therapeutic Agent
  • Enzyme Inhibitors
  • Hypolipidemic Agents
  • Lipid Regulating Agents
  • Reproductive Effect
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Names and Synonyms

Results Name

  • AY-9944

MeSH Heading

  • trans-1,4-Bis(2-chlorobenzaminomethyl)cyclohexane dihydrochloride

Synonyms

  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(o-chlorobenzyl)-, dihydrochloride
  • AY 9944
  • Benzylamine, N,N'-(1,4-cyclohexylenedimethylene)bis(2-chloro-, dihydrochloride, (E)-
  • NSC 123019
  • trans 1,4-Bis(2-dichlorobenzylaminoethyl)cyclohexane dichlorhydrate
  • trans 1,4-Bis(2-dichlorobenzylaminoethyl)cyclohexane dichlorhydrate [French]
  • trans-1,4-Bis(2-chlorobenzaminomethyl)cyclohexane dihydrochloride
  • trans-N,N'-(1,4-Cyclohexylenedimethylene)bis(2-chlorobenzylamine) dihydrochloride
  • trans-N,N'-Bis(2-chlorobenzyl)-1,4-cyclohexanebis(methylamine) dihydrochloride

Systematic Names

  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(2-chlorobenzyl)-, dihydrochloride, (E)-
  • 1,4-Cyclohexanebis(methylamine), N,N'-bis(o-chlorobenzyl)-, dihydrochloride, trans- (8CI)
  • 1,4-Cyclohexanedimethanamine, N,N'-bis((2-chlorophenyl)methyl)-, dihydrochloride, trans-

Registry Numbers

CAS Registry Number

  • 366-93-8

System Generated Number

  • 0000366938

Molecular Formulas

Molecular Formula

  • C22-H28-Cl2-N2.2Cl-H

Molecular Formula Fragments

  • C22-H28-Cl2-N2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H28Cl2N2.2ClH/c23-21-7-3-1-5-19(21)15-25-13-17-9-11-18(12-10-17)14-26-16-20-6-2-4-8-22(20)24;;/h1-8,17-18,25-26H,9-16H2;2*1H/t17-,18-;;

InChIKey

NRVIEWRSGDDWHP-PMXFUEHMSA-N

Smiles

c1(c(cccc1)Cl)CNC[C@H]1CC[C@H](CNCc2c(cccc2)Cl)CC1.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 155mg/kg (155mg/kg)   Proceedings of the Society for Experimental Biology and Medicine. Vol. 139, Pg. 100, 1972.