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PC-PEG11-Azide

CAT: 0931-T18524-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T18524-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2353409-89-7
Target
PROTAC Linker, Others
Related Pathways
PROTAC, Others
Bioactivity
PC-PEG11-Azide is a PEG-based linker for PROTACs that joins two essential ligands, crucial for forming PROTAC molecules, enabling selective protein degradation by leveraging the ubiquitin-proteasome system within cells.
Smiles
COc1cc(c(cc1OCCCC(=O)NCCOCCOCCN=[N+]=[N-])C(C)O)N(=O)=O
Molecular Formula
C19H29N5O8
Molecular Weight
455.468
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

PC-PEG11-Azide
CAS Number2353409-89-7
PubChem CID137334069
IUPAC NameN-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-4-[5-(1-hydroxyethyl)-2-methoxy-4-nitrophenoxy]butanamide
Molecular FormulaC37H65N5O17
Molecular Weight851.9
XLogP0.1
Topological Polar Surface Area230
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count19
Rotatable Bond Count43
Heavy Atom Count59
Formal Charge0
Complexity1030
SMILES
CC(C1=CC(=C(C=C1[N+](=O)[O-])OC)OCCCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN=[N+]=[N-])O
InChI
InChI=1S/C37H65N5O17/c1-32(43)33-30-36(35(47-2)31-34(33)42(45)46)59-7-3-4-37(44)39-5-8-48-10-12-50-14-16-52-18-20-54-22-24-56-26-28-58-29-27-57-25-23-55-21-19-53-17-15-51-13-11-49-9-6-40-41-38/h30-32,43H,3-29H2,1-2H3,(H,39,44)
InChIKey
MRHIPHHAKWDGIH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PC-PEG11-Azide
CAS: 2353409-89-7
CID: 137334069
Formula: C37H65N5O17
MW: 851.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight851.9
XLogP30.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count19
Rotatable Bond Count43
Exact Mass851.43754562
Monoisotopic Mass851.43754562
Topological Polar Surface Area230 Ų
Heavy Atom Count59
Formal Charge0
Complexity1030
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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