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N-Mal-N-bis (PEG2-acid)

CAT: 0931-T16227-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T16227-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2110449-02-8
Target
PROTAC Linker, Others
Related Pathways
PROTAC, Others
Bioactivity
N-Mal-N-bis (PEG2-acid) is a PEG-based linker used in PROTACs to join two essential ligands, facilitating selective protein degradation through the ubiquitin-proteasome system in cells.
Smiles
OC(=O)CCOCCOCCN(CCOCCOCCC(O)=O)C(=O)CCN1C(=O)C=CC1=O
Molecular Formula
C21H32N2O11
Molecular Weight
488.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-Mal-N-bis(PEG2-acid)
CAS Number2110449-02-8
PubChem CID129012725
IUPAC Name3-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethyl-[3-(2,5-dioxopyrrol-1-yl)propanoyl]amino]ethoxy]ethoxy]propanoic acid
Molecular FormulaC21H32N2O11
Molecular Weight488.5
XLogP-2.7
Topological Polar Surface Area169
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count21
Heavy Atom Count34
Formal Charge0
Complexity663
SMILES
C1=CC(=O)N(C1=O)CCC(=O)N(CCOCCOCCC(=O)O)CCOCCOCCC(=O)O
InChI
InChI=1S/C21H32N2O11/c24-17(3-6-23-18(25)1-2-19(23)26)22(7-11-33-15-13-31-9-4-20(27)28)8-12-34-16-14-32-10-5-21(29)30/h1-2H,3-16H2,(H,27,28)(H,29,30)
InChIKey
IEXQAPPGJQEYIT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-Mal-N-bis(PEG2-acid)
CAS: 2110449-02-8
CID: 129012725
Formula: C21H32N2O11
MW: 488.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight488.5
XLogP3-2.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count11
Rotatable Bond Count21
Exact Mass488.20060984
Monoisotopic Mass488.20060984
Topological Polar Surface Area169 Ų
Heavy Atom Count34
Formal Charge0
Complexity663
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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Alternative Products

CatalogName
MBS5769617N-Mal-N-bis(PEG2-acid)
GTR19226284-01N-Mal-N-bis (PEG2-acid)
HY-140570N-Mal-N-bis (PEG2-amine)
MBS5769618N-Mal-N-bis(PEG2-amine)
HY-W877850-01Mal-C5-N-bis (PEG2-C2-acid)
HY-140574N-Mal-N-bis (PEG2-NH-Boc)
MBS5769620N-Mal-N-bis(PEG2-NH-Boc)
GTR19226282-01N-Mal-N-bis (PEG2-C2-Boc)
MBS5769619N-Mal-N-bis(PEG2-C2-Boc)
572920N-Mal-N-bis(PEG2-NHS ester)

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