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Mal-PEG4-PFP ester

CAT: 0013-GTR19226366Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19226366Size:2 mg
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Description
Mal-PEG4-PFP ester is a heterobifunctional, non-cleavable linker used to construct antibody-drug conjugates (ADCs) . Its maleimide group targets cysteine residues on antibodies, while the PFP ester reacts with amine-containing payloads, enabling stable conjugation for both in vitro and in vivo therapeutic research.
CAS Number
1415800-42-8
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (OC=1C (F) =C (F) C (F) =C (F) C1F) CCOCCOCCOCCOCCN2C (=O) C=CC2=O
Molecular Formula
C21H22F5NO8
Molecular Weight
511.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Mal-PEG4-PFP
CAS Number1415800-42-8
PubChem CID77078506
IUPAC Name(2,3,4,5,6-pentafluorophenyl) 3-[2-[2-[2-[2-(2,5-dioxopyrrol-1-yl)ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC21H22F5NO8
Molecular Weight511.4
XLogP0.8
Topological Polar Surface Area101
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count17
Heavy Atom Count35
Formal Charge0
Complexity696
SMILES
C1=CC(=O)N(C1=O)CCOCCOCCOCCOCCC(=O)OC2=C(C(=C(C(=C2F)F)F)F)F
InChI
InChI=1S/C21H22F5NO8/c22-16-17(23)19(25)21(20(26)18(16)24)35-15(30)3-5-31-7-9-33-11-12-34-10-8-32-6-4-27-13(28)1-2-14(27)29/h1-2H,3-12H2
InChIKey
XGSVXFAIAZKWST-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mal-PEG4-PFP
CAS: 1415800-42-8
CID: 77078506
Formula: C21H22F5NO8
MW: 511.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight511.4
XLogP30.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count13
Rotatable Bond Count17
Exact Mass511.12655747
Monoisotopic Mass511.12655747
Topological Polar Surface Area101 Ų
Heavy Atom Count35
Formal Charge0
Complexity696
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