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Azido-PEG3-Ala-Boc

CAT: 0804-HY-140849Size: 1 EachDry Ice: NoHazardous: No
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Description
Azido-PEG3-Ala-Boc is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Azido-PEG3-Ala-Boc 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
2054345-68-3
UNSPSC
12352211
Target
PROTAC Linkers
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/azido-peg3-ala-boc.html
Solubility
10 mM in DMSO
Smiles
O=C(OC(C)(C)C)N[C@@H](C(O)=O)COCCOCCOCCN=[N+]=[N-]
Molecular Formula
C14H26N4O7
Molecular Weight
362.38
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
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Azido-PEG3-Ala-Boc
CAS Number2054345-68-3
PubChem CID123132040
IUPAC Name(2R)-3-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Molecular FormulaC14H26N4O7
Molecular Weight362.38
XLogP1
Topological Polar Surface Area118
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Heavy Atom Count25
Formal Charge0
Complexity447
SMILES
CC(C)(C)OC(=O)N[C@H](COCCOCCOCCN=[N+]=[N-])C(=O)O
InChI
InChI=1S/C14H26N4O7/c1-14(2,3)25-13(21)17-11(12(19)20)10-24-9-8-23-7-6-22-5-4-16-18-15/h11H,4-10H2,1-3H3,(H,17,21)(H,19,20)/t11-/m1/s1
InChIKey
NYDWDSHNHZCWMW-LLVKDONJSA-N
Chemical Structure
2D Structure
2D structure of Azido-PEG3-Ala-Boc
CAS: 2054345-68-3
CID: 123132040
Formula: C14H26N4O7
MW: 362.38
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight362.38
XLogP31
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Exact Mass362.18014918
Monoisotopic Mass362.18014918
Topological Polar Surface Area118 Ų
Heavy Atom Count25
Formal Charge0
Complexity447
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5768512Azido-PEG3-Ala-Boc
OR1035778-01Azido-PEG3-C-Boc
T18379-01N- (Azido-PEG3) -N-bis (PEG3-Boc)
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MBS5769581N-(Azido-PEG3)-N-Boc-PEG3-acid
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T16190-01N- (Azido-PEG3) -N-Boc-PEG4-Boc
GTR19226320-01N- (Azido-PEG2) -N-Boc-PEG3-Boc
MBS5769583N-(Azido-PEG3)-N-Boc-PEG4-Boc

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