K-Ras ligand-Linker Conjugate 5 | CAS 2378261-85-7

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HIT ID:HIT212667819
Cas No:2378261-85-7
常用名:K-Ras ligand-Linker Conjugate 5
IUPAC:tert-butyl (2S)-2-(cyanomethyl)-4-(2-{[(2S,4R)-4-(2-{2-[2-(2-hydroxyethoxy)ethoxy]ethoxy}ethoxy)-1-methylpyrrolidin-2-yl]methoxy}-7-(naphthalen-1-yl)-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate
IUPAC:tert-butyl (2S)-2-(cyanomethyl)-4-(2-{[(2S,4R)-4-(2-{2-[2-(2-hydroxyethoxy)ethoxy]ethoxy}ethoxy)-1-methylpyrrolidin-2-yl]methoxy}-7-(naphthalen-1-yl)-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate
InChI key:YWJHMWJHKMFQGA-DHWXLLNHSA-N

分子式:C42H59N7O8
分子量:789.975
氢键供体数 (HBD):1
氢键受体数 (HBA):13
LogP:3.9452918
SMILES:CN1C[C@@H](C[C@H]1COc1nc2CN(CCc2c(n1)N1CCN([C@@H](CC#N)C1)C(=O)OC(C)(C)C)c1cccc2ccccc12)OCCOCCOCCOCCO
SMILES:CN1C[C@@H](C[C@H]1COc1nc2CN(CCc2c(n1)N1CCN([C@@H](CC#N)C1)C(=O)OC(C)(C)C)c1cccc2ccccc12)OCCOCCOCCOCCO

K-Ras ligand-Linker Conjugate 5 is a chemical compound that combines a ligand for the K-Ras recruiting moiety with a PROTAC linker. This linker is responsible for recruiting E3 ligases such as VHL, CRBN, MDM2, and IAP. The K-Ras ligand-Linker Conjugate 5 plays a crucial role in the synthesis of PROTAC K-Ras Degrader-1, a highly potent K-Ras degrader. In SW1573 cells, this degrader exhibits an impressive degradation efficacy of ≥70% [1].

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