| Identification | Back Directory | [Name]
BET-IN-4 | [CAS]
1801503-93-4 | [Synonyms]
ODM-207
BET-IN-4
2(1H)-Quinolinone, 6-(3,5-dimethyl-4-isoxazolyl)-7-methoxy-3-methyl-1-(2-pyridinylmethyl)- | [Molecular Formula]
C22H21N3O3 | [MDL Number]
MFCD32062736 | [MOL File]
1801503-93-4.mol | [Molecular Weight]
375.42 |
| Chemical Properties | Back Directory | [Boiling point ]
529.0±50.0 °C(Predicted) | [density ]
1.232±0.06 g/cm3(Predicted) | [storage temp. ]
Store at -20°C | [solubility ]
DMSO : 10 mg/mL (26.64 mM; ultrasonic and warming and heat to 60°C) | [form ]
Solid | [pka]
4.36±0.12(Predicted) | [color ]
Off-white to light yellow | [InChI]
InChI=1S/C22H21N3O3/c1-13-9-16-10-18(21-14(2)24-28-15(21)3)20(27-4)11-19(16)25(22(13)26)12-17-7-5-6-8-23-17/h5-11H,12H2,1-4H3 | [InChIKey]
YVGWSVHZXWFLIT-UHFFFAOYSA-N | [SMILES]
N1(CC2=NC=CC=C2)C2=C(C=C(C3=C(C)ON=C3C)C(OC)=C2)C=C(C)C1=O |
| Hazard Information | Back Directory | [Uses]
ODM-207 (BET-IN-4) is a potent BET bromodomain protein (BRD4) inhibitor, with an IC50 of ≤ 1 μM[1]. | [IC 50]
BRD4: ≤ 1 μM (IC50) | [storage]
Store at -20°C | [References]
[1] Susanta Samajdar, et al. Bicyclic heterocyclic derivatives as bromodomain inhibitors. WO2015104653A1 |
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