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Ms-PEG6-THP

CAT: 0931-T40530-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0931-T40530-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
42607-89-6
Target
PROTAC Linker, Others
Related Pathways
Others, PROTAC
Bioactivity
Ms-PEG6-THP is a PEG-based linker for PROTACs, joining two essential ligands crucial for forming PROTAC molecules and enabling selective protein degradation by leveraging the ubiquitin-proteasome system within cells.
Smiles
CS(=O)(=O)OCCOCCOCCOCCOCCOCCOC1CCCCO1
Molecular Formula
C18H36O10S
Molecular Weight
444.54
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ms-PEG6-THP
CAS Number42607-89-6
PubChem CID156597072
IUPAC Name2-[2-[2-[2-[2-[2-(oxan-2-yloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl methanesulfonate
Molecular FormulaC18H36O10S
Molecular Weight444.5
XLogP-0.4
Topological Polar Surface Area116
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count20
Heavy Atom Count29
Formal Charge0
Complexity454
SMILES
CS(=O)(=O)OCCOCCOCCOCCOCCOCCOC1CCCCO1
InChI
InChI=1S/C18H36O10S/c1-29(19,20)28-17-15-25-13-11-23-9-7-21-6-8-22-10-12-24-14-16-27-18-4-2-3-5-26-18/h18H,2-17H2,1H3
InChIKey
PCSQWQKEAAOPKF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ms-PEG6-THP
CAS: 42607-89-6
CID: 156597072
Formula: C18H36O10S
MW: 444.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight444.5
XLogP3-0.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count20
Exact Mass444.20291851
Monoisotopic Mass444.20291851
Topological Polar Surface Area116 Ų
Heavy Atom Count29
Formal Charge0
Complexity454
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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