TCO-PEG4-TCO

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TCO-PEG4-TCO

TCO-PEG4-TCO | 2243569-23-3

Catelog Number R15-0009
Category TCO
Molecular Formula C₂₈H₄₈N₂O₈
Molecular Weight 540.69
Catalog Number Size Price Quantity
R15-0009 -- $--

Product Introduction

TCO-PEG4-TCO is a polyethylene glycol (PEG)-based PROTAC linker. TCO-PEG4-TCO can be used in the synthesis of a series of PROTACs.

Chemical Information

Synonyms Di(cyclooct-4-en-1-yl) (3,6,9,12-tetraoxatetradecane-1,14-diyl)dicarbamate; (4Z)-cyclooct-4-en-1-yl N-[14-({[(4Z)-cyclooct-4-en-1-yloxy]carbonyl}amino)-3,6,9,12-tetraoxatetradecan-1-yl]carbamate
Purity 95%
IUPAC Name [(4Z)-cyclooct-4-en-1-yl] N-[2-[2-[2-[2-[2-[[(4Z)-cyclooct-4-en-1-yl]oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Canonical SMILES C1CC=CCCC(C1)OC(=O)NCCOCCOCCOCCOCCNC(=O)OC2CCCC=CCC2
InChI InChI=1S/C28H48N2O8/c31-27(37-25-11-7-3-1-4-8-12-25)29-15-17-33-19-21-35-23-24-36-22-20-34-18-16-30-28(32)38-26-13-9-5-2-6-10-14-26/h1-3,5,25-26H,4,6-24H2,(H,29,31)(H,30,32)/b3-1-,5-2-
InChI Key ZLDVUVLAIKSQGP-LEWNYYKSSA-N
Solubility DMSO, DCM, DMF

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 8
Rotatable Bond Count 19
Exact Mass 540.34106649 g/mol
Monoisotopic Mass 540.34106649 g/mol
Topological Polar Surface Area 114Ų
Heavy Atom Count 38
Formal Charge 0
Complexity 617
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 2
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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