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Boc-NH-PEG7-propargyl

CAT: 0931-T14757-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T14757-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2112737-90-1
Target
PROTAC Linker, Others
Related Pathways
PROTAC, Others
Bioactivity
Boc-NH-PEG7-propargyl is a PEG-based linker for PROTACs, joining two essential ligands crucial for forming PROTAC molecules, and enables selective protein degradation by leveraging the ubiquitin-proteasome system within cells.
Smiles
C(OCCOCCOCCOCCOCCOCCOCC#C)CNC(OC(C)(C)C)=O
Molecular Formula
C22H41NO9
Molecular Weight
463.56
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

t-Boc-N-Amido-PEG7-propargyl
CAS Number2112737-90-1
PubChem CID129009590
IUPAC Nametert-butyl N-[2-[2-[2-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate
Molecular FormulaC22H41NO9
Molecular Weight463.6
XLogP0
Topological Polar Surface Area103
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count24
Heavy Atom Count32
Formal Charge0
Complexity474
SMILES
CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCCOCCOCC#C
InChI
InChI=1S/C22H41NO9/c1-5-7-25-9-11-27-13-15-29-17-19-31-20-18-30-16-14-28-12-10-26-8-6-23-21(24)32-22(2,3)4/h1H,6-20H2,2-4H3,(H,23,24)
InChIKey
KJDMOHBSNFYPKQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of t-Boc-N-Amido-PEG7-propargyl
CAS: 2112737-90-1
CID: 129009590
Formula: C22H41NO9
MW: 463.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight463.6
XLogP30
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count24
Exact Mass463.27813189
Monoisotopic Mass463.27813189
Topological Polar Surface Area103 Ų
Heavy Atom Count32
Formal Charge0
Complexity474
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