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2056014-40-3

2056014-40-3 Structure

2056014-40-3 Structure
IdentificationBack Directory
[Name]

BLM-IN-1
[CAS]

2056014-40-3
[Synonyms]

BLM-IN-1
BLMIN1,BLM IN 1
Pyrrolo[2,1-b]quinazolin-9(1H)-one, 6-[[3-(diethylamino)propyl]amino]-7-fluoro-2,3-dihydro-3-[[4-(1-methylethyl)phenyl]methylene]-, (3E)-
[Molecular Formula]

C28H35FN4O
[MDL Number]

MFCD32062677
[MOL File]

2056014-40-3.mol
[Molecular Weight]

462.6
Chemical PropertiesBack Directory
[Boiling point ]

630.0±65.0 °C(Predicted)
[density ]

1.16±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 8.33 mg/mL (18.01 mM; Need ultrasonic)
[form ]

Solid
[pka]

10.33±0.25(Predicted)
[color ]

Light yellow to yellow
Hazard InformationBack Directory
[Uses]

BLM-IN-1 is an effective bloom syndrome protein (BLM) inhibitor. BLM-IN-1 has a high binding affinity with a KD valueof 1.81 μM. BLM-IN-1 has good inhibitory effect for BLM with an IC50 value of 0.95 μM. BLM-IN-1 can induce cell apoptosis. BLM-IN-1can be used for the research of DNA damage and cancer[1].
[storage]

Store at -20°C
[References]

[1] Yin QK, et al. Discovery of Isaindigotone Derivatives as Novel Bloom's Syndrome Protein (BLM) Helicase Inhibitors That Disrupt the BLM/DNA Interactions and Regulate the Homologous Recombination Repair. J Med Chem. 2019 Mar 28;62(6):3147-3162. DOI:10.1021/acs.jmedchem.9b00083
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