N-(Azido-PEG3)-N-bis(PEG4-acid)

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N-(Azido-PEG3)-N-bis(PEG4-acid)

N-(Azido-PEG3)-N-bis(PEG4-acid) | 2112731-54-9

Catalog Number R14-0069
Category Azides
Molecular Formula C₃₀H₅₈N₄O₁₅
Molecular Weight 714.80
Catalog Number Size Price Quantity
R14-0069 -- $--

Product Introduction

N-(Azido-PEG3)-N-bis(PEG4-acid) is a polyethylene glycol (PEG)-based PROTAC linker. N-(Azido-PEG3)-N-bis(PEG4-acid) can be used in the synthesis of a series of PROTACs.

Chemical Information

Synonyms 16-(2-(2-(2-(2-azidoethoxy)ethoxy)ethoxy)ethyl)-4,7,10,13,19,22,25,28-octaoxa-16-azahentriacontanedioic acid
Purity 98%
IUPAC Name 3-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Canonical SMILES C(COCCOCCOCCOCCN(CCOCCOCCOCCN=[N+]=[N-])CCOCCOCCOCCOCCC(=O)O)C(=O)O
InChI InChI=1S/C30H58N4O15/c31-33-32-3-9-41-15-21-47-22-16-42-10-4-34(5-11-43-17-23-48-27-25-45-19-13-39-7-1-29(35)36)6-12-44-18-24-49-28-26-46-20-14-40-8-2-30(37)38/h1-28H2,(H,35,36)(H,37,38)
InChI Key FXPSMOCUUZDFRW-UHFFFAOYSA-N
  • Product Specification
Storage Please store the product under the recommended conditions in the Certificate of Analysis.

Computed Properties

XLogP3 -3.7
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 42
Exact Mass 714.38986716 g/mol
Monoisotopic Mass 714.38986716 g/mol
Topological Polar Surface Area 194Ų
Heavy Atom Count 49
Formal Charge 0
Complexity 740
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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