ChemicalBook--->CAS DataBase List--->313526-24-8

313526-24-8

313526-24-8 Structure

313526-24-8 Structure
IdentificationBack Directory
[Name]

Isoquinoline, 1,2-dihydro-1-(1H-indol-3-yl)-2-[(phenylmethyl)sulfonyl]-
[CAS]

313526-24-8
[Synonyms]

IBR2
IBR2 (IBR 2)
RAD51,Apoptosis,IBR-2,IBR2,inhibit,Inhibitor,IBR 2
2-(Benzylsulfonyl)-1-(1H-indol-3-yl)-1,2-dihydroisoquinoline
Isoquinoline, 1,2-dihydro-1-(1H-indol-3-yl)-2-[(phenylmethyl)sulfonyl]-
[Molecular Formula]

C24H20N2O2S
[MDL Number]

MFCD00991660
[MOL File]

313526-24-8.mol
[Molecular Weight]

400.49
Chemical PropertiesBack Directory
[Boiling point ]

651.2±65.0 °C(Predicted)
[density ]

1.38±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : ≥ 150 mg/mL (374.54 mM)
[form ]

Solid
[pka]

16.67±0.30(Predicted)
[color ]

Off-white to pink
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard InformationBack Directory
[Uses]

IBR2 is a potent and specific RAD51 inhibitor and inhibits RAD51-mediated DNA double-strand break repair. IBR2 disrupts RAD51 multimerization, accelerates proteasome-mediated RAD51 protein degradation, inhibits cancer cell growth and induces apoptosis[1][2].
[storage]

Store at -20°C
[References]

[1] Jiewen Zhu, et al. A novel small molecule RAD51 inactivator overcomes imatinib-resistance in chronic myeloid leukaemia. EMBO Mol Med. 2013 Mar;5(3):353-65. DOI:10.1002/emmm.201201760
[2] Zhu J, et al. Synthesis, molecular modeling, and biological evaluation of novel RAD51 inhibitors. Eur J Med Chem. 2015;96:196-208. DOI:10.1016/j.ejmech.2015.04.021
Spectrum DetailBack Directory
[Spectrum Detail]

Isoquinoline, 1,2-dihydro-1-(1H-indol-3-yl)-2-[(phenylmethyl)sulfonyl]-(313526-24-8)1HNMR
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