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Mal-amido-PEG1-C2-​NHS ester

CAT: 0013-GTR19215643-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19215643-01Size:100 mg
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Description
This noncleavable ADC linker features a maleimide group for thiol conjugation and an NHS ester for amine modification, enabling the construction of stable antibody-drug conjugates for targeted cancer therapy research in both in vitro and in vivo models.
CAS Number
1260092-50-9
Field of Research
Cell Biology, Pharmacology & Drug Discovery
Smiles
O=C (CCN1C (=O) C=CC1=O) NCCOCCC (=O) ON1C (=O) CCC1=O
Molecular Formula
C16H19N3O8
Molecular Weight
381.34
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

2,5-dioxopyrrolidin-1-yl 3-(2-(3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido)ethoxy)propanoate
CAS Number1260092-50-9
PubChem CID59257610
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 3-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]propanoate
Molecular FormulaC16H19N3O8
Molecular Weight381.34
XLogP-2.5
Topological Polar Surface Area139
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count11
Heavy Atom Count27
Formal Charge0
Complexity653
SMILES
C1CC(=O)N(C1=O)OC(=O)CCOCCNC(=O)CCN2C(=O)C=CC2=O
InChI
InChI=1S/C16H19N3O8/c20-11(5-8-18-12(21)1-2-13(18)22)17-7-10-26-9-6-16(25)27-19-14(23)3-4-15(19)24/h1-2H,3-10H2,(H,17,20)
InChIKey
QXGYXAOYQWRQRZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-dioxopyrrolidin-1-yl 3-(2-(3-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanamido)ethoxy)propanoate
CAS: 1260092-50-9
CID: 59257610
Formula: C16H19N3O8
MW: 381.34
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight381.34
XLogP3-2.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count11
Exact Mass381.11721457
Monoisotopic Mass381.11721457
Topological Polar Surface Area139 Ų
Heavy Atom Count27
Formal Charge0
Complexity653
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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