CEP-28122
- Optical Purity: 0.99
- Soluble in 0.1N HCl(aq) and DMSO
- MF: C28H35ClN6O3
- MW: 539.07
Description
CEP-28122 is a highly potent, selective and orally active ALK inhibitor (Ezymatic IC50: 1.9 nM, 3 nM, Cellular IC50: 30 nM), Cellular IC50 in 75% murine: 300 nM), displaying a favorable pharmaceutical and pharmacokinetic profile and robust and selective pharmacologic efficacy against ALK-positive human cancer cells and tumor xenograft models in mice.
More Information
| Parent CAS No. | 1022958-60-6 |
|---|---|
| Chemical Name | (1S,2S,3R,4R)-3-(5-chloro-2-((S)-1-methoxy-7-morpholino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-2-ylamino)pyrimidin-4-ylamino)bicyclo[2.2.1]hept-5-ene-2-carboxamide |
| extra_info | Sold in collaboration with Chemietek |
| SMILES | C1C2C=CC(NC3N=CC(Cl)=C(N[C@@H]4[C@@H]5C[C@@H](C=C5)[C@@H]4C(=O)N)N=3)=C(OC)C=2CC[C@@H](N2CCOCC2)C1 |&1:13,14,16,19,30,r| |
| MFCD | N.A. |
| InChi | InChI=1S/C28H35ClN6O3/c1-37-25-20-8-7-19(35-10-12-38-13-11-35)6-4-16(20)5-9-22(25)32-28-31-15-21(29)27(34-28)33-24-18-3-2-17(14-18)23(24)26(30)36/h2-3,5,9,15,17-19,23-24H,4,6-8,10-14H2,1H3,(H2,30,36)(H2,31,32,33,34)/t17-,18+,19+,23+,24-/m1/s1 |
| InChiKey | LAJAFFLJAJMYLK-CVOKMOJFSA-N |
| CID | 57325421 |
| Short Description | ALK inhibitor |
References
- M Cheng et al. CEP-28122, a highly potent and selective orally active inhibitor of anaplastic lymphoma kinase with antitumor activity in experimental models of human cancers. Mol Cancer Ther. 2012 Mar;11(3):670-9.
- MJ Jacobs, et al. Fused bicyclic 2,4-diaminopyrimidine derivative as a dual alk and fak inhibitor. 2013 WO2013134353A1
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