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MS-PEG1-THP

CAT: 0013-GTR19222461-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19222461-01Size:100 mg
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Description
MS-PEG1-THP is a polyethylene glycol (PEG) -based linker used to construct PROTAC molecules. It connects a target protein ligand to an E3 ligase ligand, enabling targeted protein degradation via the ubiquitin-proteasome system in cellular and biochemical research.
CAS Number
1309248-13-2
Field of Research
Immunology & Inflammation; Cell Biology, Pharmacology & Drug Discovery
Smiles
CS (=O) (=O) OCCOC1CCCCO1
Molecular Formula
C8H16O5S
Molecular Weight
224.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

MS-Peg1-thp
CAS Number1309248-13-2
PubChem CID17834397
IUPAC Name2-(oxan-2-yloxy)ethyl methanesulfonate
Molecular FormulaC8H16O5S
Molecular Weight224.28
XLogP0.4
Topological Polar Surface Area70.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count14
Formal Charge0
Complexity243
SMILES
CS(=O)(=O)OCCOC1CCCCO1
InChI
InChI=1S/C8H16O5S/c1-14(9,10)13-7-6-12-8-4-2-3-5-11-8/h8H,2-7H2,1H3
InChIKey
BRJFJMDXOWYTNC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of MS-Peg1-thp
CAS: 1309248-13-2
CID: 17834397
Formula: C8H16O5S
MW: 224.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.28
XLogP30.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass224.07184478
Monoisotopic Mass224.07184478
Topological Polar Surface Area70.2 Ų
Heavy Atom Count14
Formal Charge0
Complexity243
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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