XJTU-L453 is a PI3Kα inhibitor with an IC50 value of 0.4 nM. XJTU-L453 can inhibit the proliferation of breast cancer cell lines T47D and MCF7, with IC50 values of 0.2 μM and 0.5 μM, respectively. XJTU-L453 can inhibit the PI3K pathway, induce cell cycle arrest, and trigger cell apoptosis (apoptosis). XJTU-L453 also has antitumor activity in MCF7 xenograft mice.
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Name | XJTU-L453 |
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Iupac Chemical Name | (2S)-2-([9-[6-(Ethylamino)pyrimidin-4-yl]-6H-dibenzo[b,d]pyran-3-yl]oxy)propanamide |
Synonyms | XJTU-L453 |
Molecular Formula | C22H22N4O3 |
Molecular Weight | 390.44 |
Smile | NC([C@@H](OC1=CC(OCC2=C3C=C(C4=NC=NC(NCC)=C4)C=C2)=C3C=C1)C)=O |
InChiKey | ZAAQWCBZFVQJNN-ZDUSSCGKSA-N |
InChi | InChI=1S/C22H22N4O3/c1-3-24-21-10-19(25-12-26-21)14-4-5-15-11-28-20-9-16(29-13(2)22(23)27)6-7-17(20)18(15)8-14/h4-10,12-13H,3,11H2,1-2H3,(H2,23,27)(H,24,25,26)/t13-/m0/s1 |
CAS Number | 3008290-92-1 |
Related CAS |
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Formulation | Off-white solid |
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Purity | 98% Min. |
Storage | Dry, dark and at 0 - 4℃ for short term (days to weeks) or -20℃ for long term (months to years). |
Solubility | Soluble in DMSO |
Handling | |
Shipping Condition | Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs. |
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[1]. Shi X, et al. Rational Design of a Novel 6H-Benzo[c]chromen Series as Selective PI3Kα Inhibitors. J Med Chem. 2024 Aug 19.