ChemicalBook--->CAS DataBase List--->440662-09-9

440662-09-9

440662-09-9 Structure

440662-09-9 Structure
IdentificationBack Directory
[Name]

CeMMEC1
[CAS]

440662-09-9
[Synonyms]

CeMMEC1
cemmecl
CeMMEC1(free base)
4-Isoquinolinecarboxamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-dihydro-2-methyl-1-oxo-
[Molecular Formula]

C19H16N2O4
[MDL Number]

MFCD02939849
[MOL File]

440662-09-9.mol
[Molecular Weight]

336.34
Chemical PropertiesBack Directory
[Boiling point ]

590.1±50.0 °C(Predicted)
[density ]

1.386±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMF: 20 mg/ml; DMSO: 20 mg/ml; DMSO:PBS (pH 7.2) (1:1): 0.5 mg/ml
[form ]

A crystalline solid
[pka]

11.38±0.20(Predicted)
[color ]

White to off-white
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Description]

CeMMEC1 is an N-methylisoquinolinone that inhibits the second bromodomain of TAF1 (Kd = 1.8 μM; IC50 = 0.9 μM). It does not bind to either the first or second bromodomain of BRD4. This compound synergizes with (+)-JQ1 to inhibit the proliferation of THP-1 and H23 lung adenocarcinoma cells.
[Uses]

CeMMEC1, shows high affinity for TAF1, and is an inhibitor of BRD4.
[storage]

Store at -20°C
[References]

[1] SARA SDELCI. Mapping the chemical chromatin reactivation landscape identifies BRD4-TAF1 cross-talk[J]. Nature chemical biology, 2016, 12 7: 504-510. DOI: 10.1038/nchembio.2080
Spectrum DetailBack Directory
[Spectrum Detail]

CeMMEC1(440662-09-9)1HNMR
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