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Benzyl-PEG5-NHBoc

CAT: 0013-GTR19222315-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19222315-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Benzyl-PEG5-NHBoc is a flexible, heterobifunctional PEG linker used to construct PROTAC molecules for targeted protein degradation. It facilitates the assembly of E3 ligase and target protein ligands, enabling the study of protein function in both cellular and in vivo models through the ubiquitin-proteasome system.
CAS Number
2064292-55-1
Field of Research
Pharmacology & Drug Discovery, Stem Cell & Developmental Biology
Smiles
CC (C) (C) OC (=O) NCCOCCOCCOCCOCCOCc1ccccc1
Molecular Formula
C22H37NO7
Molecular Weight
427.538
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Benzyl-PEG5-NHBoc
CAS Number2064292-55-1
PubChem CID140765220
IUPAC Nametert-butyl N-[2-[2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl]carbamate
Molecular FormulaC22H37NO7
Molecular Weight427.5
XLogP1.7
Topological Polar Surface Area84.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count19
Heavy Atom Count30
Formal Charge0
Complexity409
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCC1=CC=CC=C1
InChI
InChI=1S/C22H37NO7/c1-22(2,3)30-21(24)23-9-10-25-11-12-26-13-14-27-15-16-28-17-18-29-19-20-7-5-4-6-8-20/h4-8H,9-19H2,1-3H3,(H,23,24)
InChIKey
OQPCQSZCXAZRET-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Benzyl-PEG5-NHBoc
CAS: 2064292-55-1
CID: 140765220
Formula: C22H37NO7
MW: 427.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight427.5
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count19
Exact Mass427.25700252
Monoisotopic Mass427.25700252
Topological Polar Surface Area84.5 Ų
Heavy Atom Count30
Formal Charge0
Complexity409
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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