Name: APN-PEG4-DBCO
Rating: 5 (10 reviews)

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HIT ID:HIT212667338
Cas No:
常用名:APN-PEG4-DBCO
IUPAC:1-(4-{2-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl}-4-oxobutanamido)-N-[4-(2-cyanoeth-1-yn-1-yl)phenyl]-3,6,9,12-tetraoxapentadecan-15-amide
IUPAC:1-(4-{2-azatricyclo[10.4.0.0^{4,9}]hexadeca-1(12),4(9),5,7,13,15-hexaen-10-yn-2-yl}-4-oxobutanamido)-N-[4-(2-cyanoeth-1-yn-1-yl)phenyl]-3,6,9,12-tetraoxapentadecan-15-amide
InChI key:OWARLUSLBQGVSH-UHFFFAOYSA-N

分子式:C39H40N4O7
分子量:676.77
氢键供体数 (HBD):2
氢键受体数 (HBA):8
LogP:3.5538845
SMILES:O=C(CCC(=O)N1Cc2ccccc2C#Cc2ccccc12)NCCOCCOCCOCCOCCC(=O)Nc1ccc(cc1)C#CC#N
SMILES:O=C(CCC(=O)N1Cc2ccccc2C#Cc2ccccc12)NCCOCCOCCOCCOCCC(=O)Nc1ccc(cc1)C#CC#N

APN-PEG4-DBCO is a cleavable linker for antibody-drug conjugates (ADCs), comprised of a four-unit PEG and a DBCO moiety. It finds application in the synthesis of ADCs[1].

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