Name: N-methyl-N'-methyl-O-(m-PEG4)-O'-(acid-PEG5)-Cy5
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HIT ID:HIT212668111
Cas No:
常用名:N-methyl-N'-methyl-O-(m-PEG4)-O'-(acid-PEG5)-Cy5
常用名:N-methyl-N'-methyl-O-(m-PEG4)-O'-(acid-PEG5)-Cy5
IUPAC:2-[(1E,3E)-5-[(2E)-5-[(17-carboxy-3,6,9,12,15-pentaoxaheptadecan-1-yl)oxy]-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-1,3,3-trimethyl-5-(2,5,8,11-tetraoxatridecan-13-yloxy)-3H-indol-1-ium chloride
IUPAC:2-[(1E,3E)-5-[(2E)-5-[(17-carboxy-3,6,9,12,15-pentaoxaheptadecan-1-yl)oxy]-1,3,3-trimethyl-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-1,3,3-trimethyl-5-(2,5,8,11-tetraoxatridecan-13-yloxy)-3H-indol-1-ium chloride
InChI key:IVWOCBLGGSXMPC-UHFFFAOYSA-N

分子式:C49H73ClN2O13
分子量:933.57
氢键供体数 (HBD):1
氢键受体数 (HBA):14
LogP:2.5185668
SMILES:[Cl-].COCCOCCOCCOCCOc1ccc2c(c1)C(C)(C)C(\C=C\C=C\C=C1\N(C)c3ccc(OCCOCCOCCOCCOCCOCCC(O)=O)cc3C1(C)C)=[N+]2C |c:64|
SMILES:[Cl-].COCCOCCOCCOCCOc1ccc2c(c1)C(C)(C)C(\C=C\C=C\C=C1\N(C)c3ccc(OCCOCCOCCOCCOCCOCCC(O)=O)cc3C1(C)C)=[N+]2C |c:64|

N-methyl-N'-methyl-O-(m-PEG4)-O'-(acid-PEG5)-Cy5, a PEG-based PROTAC linker utilized in the synthesis of PROTACs, serves as a chemical compound for efficient protein degradation [1].

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