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Mal-amido-PEG3-C1-PFP ester

CAT: 0013-GTR19222304-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19222304-01Size:100 mg
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Description
This non-cleavable Mal-amido-PEG3-C1-PFP ester linker is designed for constructing stable antibody-drug conjugates (ADCs) . It is widely used in ADC research for both in vitro and in vivo studies to develop targeted cancer therapeutics, facilitating the attachment of cytotoxic payloads to antibodies.
CAS Number
2101206-13-5
Field of Research
Cell Biology
Smiles
Fc1c (F) c (F) c (OC (=O) COCCOCCOCCNC (=O) CCN2C (=O) C=CC2=O) c (F) c1F
Molecular Formula
C21H21F5N2O8
Molecular Weight
524.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Mal-amido-PEG3-C1-PFP ester
CAS Number2101206-13-5
PubChem CID129896959
IUPAC Name(2,3,4,5,6-pentafluorophenyl) 2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]acetate
Molecular FormulaC21H21F5N2O8
Molecular Weight524.4
XLogP0.3
Topological Polar Surface Area120
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count16
Heavy Atom Count36
Formal Charge0
Complexity770
SMILES
C1=CC(=O)N(C1=O)CCC(=O)NCCOCCOCCOCC(=O)OC2=C(C(=C(C(=C2F)F)F)F)F
InChI
InChI=1S/C21H21F5N2O8/c22-16-17(23)19(25)21(20(26)18(16)24)36-15(32)11-35-10-9-34-8-7-33-6-4-27-12(29)3-5-28-13(30)1-2-14(28)31/h1-2H,3-11H2,(H,27,29)
InChIKey
ZBIQVRXGRCZPMF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Mal-amido-PEG3-C1-PFP ester
CAS: 2101206-13-5
CID: 129896959
Formula: C21H21F5N2O8
MW: 524.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight524.4
XLogP30.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count13
Rotatable Bond Count16
Exact Mass524.12180644
Monoisotopic Mass524.12180644
Topological Polar Surface Area120 Ų
Heavy Atom Count36
Formal Charge0
Complexity770
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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