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Me-Tet-PEG5-COOH

CAT: 0013-GTR19234280-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19234280-01Size:25 mg
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Description
Me-Tet-PEG5-COOH is an ADC linker designed for bioorthogonal conjugation via iEDDA click chemistry between its tetrazine moiety and trans-cyclooctene (TCO) -tagged molecules. This water-soluble linker enables precise construction of antibody-drug conjugates and targeted probes for in vitro and in vivo imaging and therapeutic research.
CAS Number
2143964-72-9
Field of Research
Stem Cell & Developmental Biology
Smiles
C (NC (CCOCCOCCOCCOCCOCCC (O) =O) =O) C1=CC=C (C=C1) C=2N=NC (C) =NN2
Molecular Formula
C24H35N5O8
Molecular Weight
521.56
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Me-Tet-PEG5-COOH
CAS Number2143964-72-9
PubChem CID138393871
IUPAC Name3-[2-[2-[2-[2-[3-[[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenyl]methylamino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular FormulaC24H35N5O8
Molecular Weight521.6
XLogP-1.5
Topological Polar Surface Area164
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count21
Heavy Atom Count37
Formal Charge0
Complexity602
SMILES
CC1=NN=C(N=N1)C2=CC=C(C=C2)CNC(=O)CCOCCOCCOCCOCCOCCC(=O)O
InChI
InChI=1S/C24H35N5O8/c1-19-26-28-24(29-27-19)21-4-2-20(3-5-21)18-25-22(30)6-8-33-10-12-35-14-16-37-17-15-36-13-11-34-9-7-23(31)32/h2-5H,6-18H2,1H3,(H,25,30)(H,31,32)
InChIKey
LUEGJYPWJFWBHK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Me-Tet-PEG5-COOH
CAS: 2143964-72-9
CID: 138393871
Formula: C24H35N5O8
MW: 521.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight521.6
XLogP3-1.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count21
Exact Mass521.24856309
Monoisotopic Mass521.24856309
Topological Polar Surface Area164 Ų
Heavy Atom Count37
Formal Charge0
Complexity602
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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