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Bromoacetamido-PEG5-azide

CAT: 0804-HY-140826-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-140826-01Size:5 mg
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Description
Bromoacetamido-PEG5-azide is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Bromoacetamido-PEG5-azide is a click chemistry reagent, it contains an Azide group and can undergo copper-catalyzed azide-alkyne cycloaddition reaction (CuAAc) with molecules containing Alkyne groups. It can also undergo strain-promoted alkyne-azide cycloaddition (SPAAC) reactions with molecules containing DBCO or BCN groups.
CAS Number
1415800-37-1
UNSPSC
12352211
Hazard Statement
H302-H315-H319-H335
Target
PROTAC Linkers
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/bromoacetamido-peg5-azide.html
Purity
95.49
Solubility
10 mM in DMSO
Smiles
O=C(NCCOCCOCCOCCOCCOCCN=[N+]=[N-])CBr
Molecular Formula
C14H27BrN4O6
Molecular Weight
427.29
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501
References & Citations
[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
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Bromoacetamido-PEG5-azide
CAS Number1415800-37-1
PubChem CID77078486
IUPAC NameN-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-2-bromoacetamide
Molecular FormulaC14H27BrN4O6
Molecular Weight427.29
XLogP0.5
Topological Polar Surface Area89.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count19
Heavy Atom Count25
Formal Charge0
Complexity358
SMILES
C(COCCOCCOCCOCCOCCN=[N+]=[N-])NC(=O)CBr
InChI
InChI=1S/C14H27BrN4O6/c15-13-14(20)17-1-3-21-5-7-23-9-11-25-12-10-24-8-6-22-4-2-18-19-16/h1-13H2,(H,17,20)
InChIKey
VSMFHNNLUORRKS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bromoacetamido-PEG5-azide
CAS: 1415800-37-1
CID: 77078486
Formula: C14H27BrN4O6
MW: 427.29
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight427.29
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count19
Exact Mass426.11140
Monoisotopic Mass426.11140
Topological Polar Surface Area89.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity358
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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