Name: N-(m-PEG4)-N'-(m-PEG4)-O-(m-PEG4)-O'-(azide-PEG4)-Cy5
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HIT ID:HIT212668095
Cas No:2107273-58-3
常用名:N-(m-PEG4)-N'-(m-PEG4)-O-(m-PEG4)-O'-(azide-PEG4)-Cy5
常用名:N-(m-PEG4)-N'-(m-PEG4)-O-(m-PEG4)-O'-(azide-PEG4)-Cy5
别名:n-m-peg4-n-m-peg4-o-m-peg4-o-azide-peg4-cy5
别名:n-m-peg4-n-m-peg4-o-m-peg4-o-azide-peg4-cy5
IUPAC:2-[(1E,3E)-5-[(2E)-5-[(14-azido-3,6,9,12-tetraoxatetradecan-1-yl)oxy]-3,3-dimethyl-1-(2,5,8,11-tetraoxatridecan-13-yl)-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-3,3-dimethyl-1-(2,5,8,11-tetraoxatridecan-13-yl)-5-(2,5,8,11-tetraoxatridecan-13-yloxy)-3H-indol-1-ium chloride
IUPAC:2-[(1E,3E)-5-[(2E)-5-[(14-azido-3,6,9,12-tetraoxatetradecan-1-yl)oxy]-3,3-dimethyl-1-(2,5,8,11-tetraoxatridecan-13-yl)-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-3,3-dimethyl-1-(2,5,8,11-tetraoxatridecan-13-yl)-5-(2,5,8,11-tetraoxatridecan-13-yloxy)-3H-indol-1-ium chloride
InChI key:PKHNSJLVAZPWTJ-UHFFFAOYSA-M

分子式:C62H100ClN5O18
分子量:1238.95
氢键供体数 (HBD):0
氢键受体数 (HBA):21
LogP:2.6204526
SMILES:[Cl-].COCCOCCOCCOCCOc1ccc2c(c1)C(C)(C)C(\C=C\C=C\C=C1\N(CCOCCOCCOCCOC)c3ccc(OCCOCCOCCOCCOCCN=[N+]=[N-])cc3C1(C)C)=[N+]2CCOCCOCCOCCOC |c:73|
SMILES:[Cl-].COCCOCCOCCOCCOc1ccc2c(c1)C(C)(C)C(\C=C\C=C\C=C1\N(CCOCCOCCOCCOC)c3ccc(OCCOCCOCCOCCOCCN=[N+]=[N-])cc3C1(C)C)=[N+]2CCOCCOCCOCCOC |c:73|

N-(m-PEG4)-N'-(m-PEG4)-O-(m-PEG4)-O'-(azide-PEG4)-Cy5 is a polyethylene glycol (PEG) derived linker compound employed in the synthesis of proteolysis targeting chimeras (PROTACs)[1].

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