ChemicalBook--->CAS DataBase List--->2250216-96-5

2250216-96-5

2250216-96-5 Structure

2250216-96-5 Structure
IdentificationBack Directory
[Name]

DBCO-PEG2-amine
[CAS]

2250216-96-5
[Synonyms]

DBCO-PEG2-amine
[Molecular Formula]

C25H29N3O4
[MDL Number]

MFCD31811529
[MOL File]

2250216-96-5.mol
[Molecular Weight]

435.52
Chemical PropertiesBack Directory
[Boiling point ]

748.9±60.0 °C(Predicted)
[density ]

1.24±0.1 g/cm3(Predicted)
[solubility ]

Soluble in DMSO, DCM, DMF
[pka]

15.14±0.46(Predicted)
[InChI]

InChI=1S/C25H29N3O4/c26-13-15-31-17-18-32-16-14-27-24(29)11-12-25(30)28-19-22-7-2-1-5-20(22)9-10-21-6-3-4-8-23(21)28/h1-8H,11-19,26H2,(H,27,29)
[InChIKey]

ILEXOUGGKQHBOX-UHFFFAOYSA-N
[SMILES]

C(N1CC2=CC=CC=C2C#CC2=CC=CC=C12)(=O)CCC(=O)NCCOCCOCCN
Hazard InformationBack Directory
[Description]

DBCO-PEG2-amine is a PEG linker which contains DBCO and amine moieties. The DBCO group is commonly used in copper-free Click Chemistry reactions. The amine group is reactive with carboxylic acids, activated NHS esters, carbonyls (ketone, aldehyde) etc. The hydrophilic PEG spacer increases the water solubility of the compound.
[Uses]

DBCO-PEG2-amine is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. DBCO-PEG2-amine is a click chemistry reagent, it contains a DBCO group that can undergo strain-promoted alkyne-azide cycloaddition (SPAAC) with molecules containing Azide groups.
[IC 50]

PEGs
[References]

[1] An S, et al. Small-molecule PROTACs: An emerging and promising approach for the development of targeted therapy drugs. EBioMedicine. 2018 Oct;36:553-562 DOI:10.1016/j.ebiom.2018.09.005
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