Name: N-(Ac-PEG3)-N'-(azide-PEG3)-Cy7 chloride
Rating: 5 (10 reviews)

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HIT ID:HIT212668037
Cas No:2107273-00-5
常用名:N-(Ac-PEG3)-N'-(azide-PEG3)-Cy7 chloride
常用名:N-(Ac-PEG3)-N'-(azide-PEG3)-Cy7 chloride
IUPAC:1-(2-{2-[2-(acetyloxy)ethoxy]ethoxy}ethyl)-2-[(1E,3E,5E)-7-[(2E)-1-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-3,3-dimethyl-2,3-dihydro-1H-indol-2-ylidene]hepta-1,3,5-trien-1-yl]-3,3-dimethyl-3H-indol-1-ium chloride
IUPAC:1-(2-{2-[2-(acetyloxy)ethoxy]ethoxy}ethyl)-2-[(1E,3E,5E)-7-[(2E)-1-(2-{2-[2-(2-azidoethoxy)ethoxy]ethoxy}ethyl)-3,3-dimethyl-2,3-dihydro-1H-indol-2-ylidene]hepta-1,3,5-trien-1-yl]-3,3-dimethyl-3H-indol-1-ium chloride
InChI key:HVDWUPHUQBHZMT-UHFFFAOYSA-M

分子式:C43H58ClN5O7
分子量:792.42
氢键供体数 (HBD):0
氢键受体数 (HBA):9
LogP:3.7307649
SMILES:[Cl-].CC(=O)OCCOCCOCC[N+]1=C(\C=C\C=C\C=C\C=C2\N(CCOCCOCCOCCN=[N+]=[N-])c3ccccc3C2(C)C)C(C)(C)c2ccccc12 |c:12|
SMILES:[Cl-].CC(=O)OCCOCCOCC[N+]1=C(\C=C\C=C\C=C\C=C2\N(CCOCCOCCOCCN=[N+]=[N-])c3ccccc3C2(C)C)C(C)(C)c2ccccc12 |c:12|

N-(Ac-PEG3)-N'-(azide-PEG3)-Cy7 (chloride) is a polyethylene glycol (PEG)-based PROTAC linker suitable for synthesizing PROTACs[1].

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