
APN-C3-PEG4-azide | CAS 2183440-32-4
Catalog Number | R14-0145 |
Category | Azides |
Molecular Formula | C₂₄H₃₂N₆O₆ |
Molecular Weight | 500.55 |
Catalog Number | Size | Price | Quantity |
---|---|---|---|
R14-0145 | -- | -- |
* Please be kindly noted products are not for therapeutic use. We do not sell to patients.
Product Introduction
APN-C3-PEG4-azide is a polyethylene glycol (PEG)-based PROTAC linker. APN-C3-PEG4-azide can be used in the synthesis of a series of PROTACs.
Chemical Information
Product Specification
Computed Properties
Synonyms | 1-azido-N-(3-{[4-(2-cyanoeth-1-yn-1-yl)phenyl]carbamoyl}propyl)-3,6,9,12-tetraoxapentadecan-15-amide; 1-azido-N-(4-((4-(cyanoethynyl)phenyl)amino)-4-oxobutyl)-3,6,9,12-tetraoxapentadecan-15-amide |
Purity | 98% |
IUPAC Name | 4-[3-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]propanoylamino]-N-[4-(2-cyanoethynyl)phenyl]butanamide |
Canonical SMILES | C1=CC(=CC=C1C#CC#N)NC(=O)CCCNC(=O)CCOCCOCCOCCOCCN=[N+]=[N-] |
InChI | InChI=1S/C24H32N6O6/c25-10-1-3-21-5-7-22(8-6-21)29-24(32)4-2-11-27-23(31)9-13-33-15-17-35-19-20-36-18-16-34-14-12-28-30-26/h5-8H,2,4,9,11-20H2,(H,27,31)(H,29,32) |
InChIKey | JKVJRGOKGCBEJR-UHFFFAOYSA-N |
Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
XLogP3 | 1.3 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 21 |
Exact Mass | 500.23833276 g/mol |
Monoisotopic Mass | 500.23833276 g/mol |
Topological Polar Surface Area | 133Ų |
Heavy Atom Count | 36 |
Formal Charge | 0 |
Complexity | 787 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
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