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Ms-PEG6-MS

CAT: 0804-HY-138324Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-138324Size:1 Each
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Description
Ms-PEG6-MS is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
CAS Number
109789-40-4
UNSPSC
12352100
Hazard Statement
H302-H315-H319-H335
Target
PROTAC Linkers
Type
Reference compound
Related Pathways
PROTAC
Applications
Cancer-programmed cell death
Field of Research
Cancer
Assay Protocol
https://www.medchemexpress.com/ms-peg6-ms.html
Solubility
10 mM in DMSO
Smiles
CS(OCCOCCOCCOCCOCCOCCOS(C)(=O)=O)(=O)=O
Molecular Formula
C14H30O11S2
Molecular Weight
438.51
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]An S, et al. Small-molecule PROTACs: An emerging and promising approach for the development of targeted therapy drugs. EBioMedicine. 2018 Oct;36:553-562
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
PEG Linkers

Chemical Information

Ms-PEG6-Ms
CAS Number109789-40-4
PubChem CID13642704
IUPAC Name2-[2-[2-[2-[2-(2-methylsulfonyloxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl methanesulfonate
Molecular FormulaC14H30O11S2
Molecular Weight438.5
XLogP-1.7
Topological Polar Surface Area150
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count20
Heavy Atom Count27
Formal Charge0
Complexity474
SMILES
CS(=O)(=O)OCCOCCOCCOCCOCCOCCOS(=O)(=O)C
InChI
InChI=1S/C14H30O11S2/c1-26(15,16)24-13-11-22-9-7-20-5-3-19-4-6-21-8-10-23-12-14-25-27(2,17)18/h3-14H2,1-2H3
InChIKey
JOECUAAPEWVDEO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ms-PEG6-Ms
CAS: 109789-40-4
CID: 13642704
Formula: C14H30O11S2
MW: 438.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight438.5
XLogP3-1.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count11
Rotatable Bond Count20
Exact Mass438.12295412
Monoisotopic Mass438.12295412
Topological Polar Surface Area150 Ų
Heavy Atom Count27
Formal Charge0
Complexity474
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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