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MC-PEG2-C2-​NHS ester

CAT: 0013-GTR19225318-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19225318-02Size:500 mg
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Description
MC-PEG2-C2-NHS ester is a non-cleavable, two-unit polyethylene glycol linker designed for constructing stable antibody-drug conjugates (ADCs) . It is widely used in ADC research to improve pharmacokinetics and is applicable in both in vitro and in vivo experimental settings for targeted cancer therapy.
CAS Number
1263044-56-9
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Smiles
O=C (ON1C (=O) CCC1=O) CCOCCOCCNC (=O) CCCCCN2C (=O) C=CC2=O
Molecular Formula
C21H29N3O9
Molecular Weight
467.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(2,5-Dioxopyrrolidin-1-yl) 3-[2-[2-[6-(2,5-dioxopyrrol-1-yl)hexanoylamino]ethoxy]ethoxy]propanoate
CAS Number1263044-56-9
PubChem CID51340883
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[6-(2,5-dioxopyrrol-1-yl)hexanoylamino]ethoxy]ethoxy]propanoate
Molecular FormulaC21H29N3O9
Molecular Weight467.5
XLogP-1.6
Topological Polar Surface Area149
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count17
Heavy Atom Count33
Formal Charge0
Complexity747
SMILES
C1CC(=O)N(C1=O)OC(=O)CCOCCOCCNC(=O)CCCCCN2C(=O)C=CC2=O
InChI
InChI=1S/C21H29N3O9/c25-16(4-2-1-3-11-23-17(26)5-6-18(23)27)22-10-13-32-15-14-31-12-9-21(30)33-24-19(28)7-8-20(24)29/h5-6H,1-4,7-15H2,(H,22,25)
InChIKey
RKGUGSULMVQEIX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (2,5-Dioxopyrrolidin-1-yl) 3-[2-[2-[6-(2,5-dioxopyrrol-1-yl)hexanoylamino]ethoxy]ethoxy]propanoate
CAS: 1263044-56-9
CID: 51340883
Formula: C21H29N3O9
MW: 467.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight467.5
XLogP3-1.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count17
Exact Mass467.19037951
Monoisotopic Mass467.19037951
Topological Polar Surface Area149 Ų
Heavy Atom Count33
Formal Charge0
Complexity747
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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