K-Ras ligand-Linker Conjugate 4 | CAS 2378261-83-5 | AnyMole

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HIT212667818

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HIT212667818

HIT ID:HIT212667818
Cas No:2378261-83-5
常用名:K-Ras ligand-Linker Conjugate 4
IUPAC:benzyl (2S)-2-(cyanomethyl)-4-(2-{[(2S,4R)-4-(2-{2-[2-(2-hydroxyethoxy)ethoxy]ethoxy}ethoxy)-1-methylpyrrolidin-2-yl]methoxy}-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate
IUPAC:benzyl (2S)-2-(cyanomethyl)-4-(2-{[(2S,4R)-4-(2-{2-[2-(2-hydroxyethoxy)ethoxy]ethoxy}ethoxy)-1-methylpyrrolidin-2-yl]methoxy}-5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate
InChI key:GUKYSZDGLMYSDL-OIFRRMEBSA-N

分子式:C35H51N7O8
分子量:697.834
氢键供体数 (HBD):2
氢键受体数 (HBA):13
LogP:1.3521603
SMILES:CN1C[C@@H](C[C@H]1COc1nc2CNCCc2c(n1)N1CCN([C@@H](CC#N)C1)C(=O)OCc1ccccc1)OCCOCCOCCOCCO
SMILES:CN1C[C@@H](C[C@H]1COc1nc2CNCCc2c(n1)N1CCN([C@@H](CC#N)C1)C(=O)OCc1ccccc1)OCCOCCOCCOCCO

K-Ras ligand-Linker Conjugate 4 is a chemical compound that combines a ligand for K-Ras recruiting moiety with a PROTAC linker. This linker is responsible for recruiting E3 ligases such as VHL, CRBN, MDM2, and IAP. The compound has the potential to be used in the synthesis of PROTAC K-Ras Degrader-1, a powerful degrader of K-Ras that has been shown to exhibit a degradation efficacy of ≥70% in SW1573 cells[1].

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