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ChemicalBook--->CAS DataBase List--->1235032-75-3

1235032-75-3

1235032-75-3 Structure

1235032-75-3 Structure
IdentificationBack Directory
[Name]

PHCCZZHEZZPUGG-UHFFFAOYSA-N
[CAS]

1235032-75-3
[Synonyms]

Bcl-xL antagonist 2
PHCCZZHEZZPUGG-UHFFFAOYSA-N
[Molecular Formula]

C21H16N4O3S2
[MOL File]

1235032-75-3.mol
[Molecular Weight]

436.51
Chemical PropertiesBack Directory
[density ]

1.545±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 62.5 mg/mL (143.18 mM; Need ultrasonic)
[form ]

Solid
[pka]

1.18±0.10(Predicted)
[color ]

Light yellow to green yellow
Spectrum DetailBack Directory
[Spectrum Detail]

PHCCZZHEZZPUGG-UHFFFAOYSA-N(1235032-75-3)1HNMR
Hazard InformationBack Directory
[Biological Activity]

Bcl-xL antagonist 2 is a potent, selective, and orally active antagonist of BCL-XL with an IC50 and Ki of 0.091 μM and 65 nM, respectively. Bcl-xL antagonist 2 promotes the apoptosis of cancer cells. Bcl-xL antagonist 2 has the potential for the research of the chronic lymphocytic leukemia (CLL) and non-Hodgkin’s lymphoma (NHL)[1][2]. Assessment of Pharmacokinetics (PK) profile of Bcl-xL antagonist 2 (compound 14) in rat[1]. iv (1 mg/kg) po (5 mg/kg) CLp (mL/min/kg) Vss (L/kg) t 1/2 (h) F % 0.47 0.16 6.0 16
[References]

[1]. Koehler MF, et al. Structure-Guided Rescaffolding of Selective Antagonists of BCL-XL. ACS Med Chem Lett. 2014;5(6):662-667. [2]. Wang L, et al. Discovery of A-1331852, a First-in-Class, Potent, and Orally-Bioavailable BCL-XL Inhibitor. ACS Med Chem Lett. 2020;11(10):1829-1836.
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