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DBCO-C3-PEG4-NH-Boc
| Catelog Number | R01-0348 |
| Category | Cycloalkyne Dyes (DBCO) |
| Molecular Formula | C₃₈H₅₁N₃O₁₀ |
| Molecular Weight | 709.83 |
| Catalog Number | Size | Price | Quantity |
|---|---|---|---|
| R01-0348 | -- | $-- |
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Product Introduction
DBCO-C3-PEG4-NH-Boc is a polyethylene glycol (PEG)-based PROTAC linker. DBCO-C3-PEG4-NH-Boc can be used in the synthesis of a series of PROTACs.
Chemical Information |
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|---|---|
| Purity | 98% |
| IUPAC Name | 3-[[4-(2-azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-4-oxobutanoyl]amino]propyl 3-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoate |
| Canonical SMILES | CC(C)(C)OC(=O)NCCOCCOCCOCCOCCC(=O)OCCCNC(=O)CCC(=O)N1CC2=CC=CC=C2C#CC3=CC=CC=C31 |
| InChI | InChI=1S/C38H51N3O10/c1-38(2,3)51-37(45)40-19-22-47-24-26-49-28-27-48-25-23-46-21-17-36(44)50-20-8-18-39-34(42)15-16-35(43)41-29-32-11-5-4-9-30(32)13-14-31-10-6-7-12-33(31)41/h4-7,9-12H,8,15-29H2,1-3H3,(H,39,42)(H,40,45) |
| InChI Key | UMONQRPDXRZGCO-UHFFFAOYSA-N |
| Solubility | DMSO, DCM, DMF |
Product Specification |
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|---|---|
| Storage | Please store the product under the recommended conditions in the Certificate of Analysis. |
Computed Properties | |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 25 |
| Exact Mass | 709.35744483 g/mol |
| Monoisotopic Mass | 709.35744483 g/mol |
| Topological Polar Surface Area | 151Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1130 |
| 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 |
Applications of Fluorescent Probes & Dyes
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