Methyltetrazine-PEG5-triethoxysilane

What We Offer

Methyltetrazine-PEG5-triethoxysilane

Methyltetrazine-PEG5-triethoxysilane | 2353410-01-0

Catalog Number R08-0020
Category Tetrazines
Molecular Formula C₂₉H₄₉N₅O₉Si
Molecular Weight 639.81
Catalog Number Size Price Quantity
R08-0020 -- $--

Product Introduction

Methyltetrazine-PEG5-triethoxysilane is a polyethylene glycol (PEG)-based PROTAC linker. Methyltetrazine-PEG5-triethoxysilane can be used in the synthesis of a series of PROTACs.

Chemical Information

Synonyms 1-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]-N-[3-(triethoxysilyl)propyl]-3,6,9,12-tetraoxapentadecan-15-amide
Purity 98%
IUPAC Name 3-[2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]-N-(3-triethoxysilylpropyl)propanamide
Canonical SMILES CCO[Si](CCCNC(=O)CCOCCOCCOCCOCCOC1=CC=C(C=C1)C2=NN=C(N=N2)C)(OCC)OCC
InChI InChI=1S/C29H49N5O9Si/c1-5-41-44(42-6-2,43-7-3)24-8-14-30-28(35)13-15-36-16-17-37-18-19-38-20-21-39-22-23-40-27-11-9-26(10-12-27)29-33-31-25(4)32-34-29/h9-12H,5-8,13-24H2,1-4H3,(H,30,35)
InChI Key KTMPHUUZMIOJLF-UHFFFAOYSA-N
Solubility DMSO, DCM, DMF
  • Product Specification
Storage Please store the product under the recommended conditions in the Certificate of Analysis.

Computed Properties

Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 27
Exact Mass 639.32995469 g/mol
Monoisotopic Mass 639.32995469 g/mol
Topological Polar Surface Area 155Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 685
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
cartIcon
Inquiry Basket