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

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

N-(Azido-PEG3)-N-Boc-PEG4-acid | 2112731-95-8

Catalog Number R14-0089
Category Azides
Molecular Formula C₂₄H₄₆N₄O₁₁
Molecular Weight 566.64
Catalog Number Size Price Quantity
R14-0089 -- $--

Product Introduction

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

Chemical Information

Synonyms 1-(16-azido-2,2-dimethyl-4-oxo-3,8,11,14-tetraoxa-5-azahexadecan-5-yl)-3,6,9,12-tetraoxapentadecan-15-oic acid; 1-azido-12-(tert-butoxycarbonyl)-3,6,9,15,18,21,24-heptaoxa-12-azaheptacosan-27-oic acid
Purity 98%
IUPAC Name 3-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Canonical SMILES CC(C)(C)OC(=O)N(CCOCCOCCOCCN=[N+]=[N-])CCOCCOCCOCCOCCC(=O)O
InChI InChI=1S/C24H46N4O11/c1-24(2,3)39-23(31)28(6-10-34-14-18-37-17-13-33-9-5-26-27-25)7-11-35-15-19-38-21-20-36-16-12-32-8-4-22(29)30/h4-21H2,1-3H3,(H,29,30)
InChI Key OADVJZWLSBSJIP-UHFFFAOYSA-N
  • Product Specification
Storage Please store the product under the recommended conditions in the Certificate of Analysis.

Computed Properties

XLogP3 0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 29
Exact Mass 566.31630830 g/mol
Monoisotopic Mass 566.31630830 g/mol
Topological Polar Surface Area 146Ų
Heavy Atom Count 39
Formal Charge 0
Complexity 659
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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