CAS 122955-42-4|XE 991 dihydrochloride

Introduction:Basic information about CAS 122955-42-4|XE 991 dihydrochloride, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameXE 991 dihydrochloride
CAS Number122955-42-4Molecular Weight376.45
Density/Boiling Point625.3ºC at 760mmHg
Molecular FormulaC26H20N2OMelting Point/
MSDSChineseUSAFlash Point332ºC
Symbol
GHS07
Signal WordWarning

Names

Name10,10-bis(4-pyridinylmethyl)-9(10H)-anthracenone
SynonymMore Synonyms

XE 991 dihydrochloride BiologicalActivity

DescriptionXE 991 dihydrochloride, a Kv7 (KCNQ) channels blocker, potently inhibits Kv7.1 (KCNQ1), Kv7.2 (KCNQ2), Kv7.2 + Kv7.3 (KCNQ3) channel, and M-current with IC50s of 0.75 μM, 0.71 μM, 0.6 μM, and 0.98 μM, respectively[1].
Related CatalogResearch Areas >>Neurological DiseaseSignaling Pathways >>Membrane Transporter/Ion Channel >>Potassium Channel
References

[1]. Wang HS, et al. KCNQ2 and KCNQ3 potassium channel subunits: molecular correlates of the M-channel. Science. 1998 Dec 4;282(5395):1890-3.  

[2]. Zaczek R, et al. Two new potent neurotransmitter release enhancers, 10,10-bis(4-pyridinylmethyl)-9(10H)-anthracenone and 10,10-bis(2-fluoro-4-pyridinylmethyl)-9(10H)-anthracenone: comparison to linopirdine. J Pharmacol Exp Ther. 1998 May;285(2):724-30.

Chemical & Physical Properties

Boiling Point625.3ºC at 760mmHg
Molecular FormulaC26H20N2O
Molecular Weight376.45
Flash Point332ºC
Exact Mass376.15800
PSA42.85000
LogP4.79250
Vapour Pressure6.84E-16mmHg at 25°C
InChIKeyKHJFBUUFMUBONL-UHFFFAOYSA-N
SMILESO=C1c2ccccc2C(Cc2ccncc2)(Cc2ccncc2)c2ccccc21
Storage condition2-8°C

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH315-H319-H335
Precautionary StatementsP261-P305 + P351 + P338
Hazard CodesXi
RIDADRNONH for all modes of transport
RTECSCB1530000

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Synonyms

10,10-bis(pyridin-4-ylmethyl)anthracen-9-one,dihydrochloride
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