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ChemicalBook--->CAS DataBase List--->729-46-4

729-46-4

729-46-4 Structure

729-46-4 Structure
IdentificationBack Directory
[Name]

4,4'-(dithiodicarbonothioyl)dimorpholine
[CAS]

729-46-4
[Synonyms]

JX 06
Bis(morpholinothiocarbonyl) disulfide
Bis(morpholinocarbonothioyl) persulfide
4,4'-(dithiodicarbonothioyl)dimorpholine
Morpholine, 4,4-(dithiodicarbonothioyl)bis-
[EINECS(EC#)]

211-980-6
[Molecular Formula]

C10H16N2O2S4
[MOL File]

729-46-4.mol
[Molecular Weight]

324.51
Chemical PropertiesBack Directory
[Melting point ]

136-137 °C
[Boiling point ]

466.3±55.0 °C(Predicted)
[density ]

1.4302 (rough estimate)
[refractive index ]

1.5650 (estimate)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[form ]

A solid
[pka]

0.58±0.20(Predicted)
[color ]

White to off-white
[EPA Substance Registry System]

Morpholine, 4,4'-(dithiodicarbonothioyl)bis- (729-46-4)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07,GHS08,GHS09
[Signal word ]

Warning
[Hazard statements ]

H302+H332-H315-H319-H317-H373-H400-H410
[Precautionary statements ]

P260-P264-P270-P271-P272-P273-P280-P301+P312-P330-P302+P352-P304+P340-P305+P351+P338-P314-P362+P364-P333+P313-P321-P337+P313-P363-P391-P501
Hazard InformationBack Directory
[Uses]

JX 06 is a covalent inhibitor of Potent Covalent Pyruvate Dehydrogenase Kinase (PDK).
[Biological Activity]

JX06 is a potentPDK1-selectivecovalent pyruvate dehydrogenase (PDH) kinase (PDHKPDK) inhibitor (PDK1/2/3 IC50 = 49/101/313 nM; PDK4 IC50 >10 μMIC50 >10 μM against >300 other kinases). JX06 inhibits cellular PDK substrate PDHA1 Ser293/232 phosphorylationresulting in reduced aerobic glycolysis and cancer proliferation in cultures (1-10 μM) and in mice in vivo (40-80 mg/kg via daily i.p. injection; A549 & HT-29 xenografts). JX06 is shown to target PDK1 Cys240 for covalent modification.
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

4,4'-(dithiodicarbonothioyl)dimorpholine(729-46-4)1HNMR
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