Methyltetrazine-PEG5-nhs ester | 1802907-92-1

Catalog Number	Size	Price	Quantity
R08-0049	--	$--

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Product Introduction

Methyltetrazine-PEG5-nhs ester is a linker widely used in antibody-drug conjugates (ADCs).

Chemical Information
Synonyms	Methyltetrazine-PEG5-NHS ester; 2,5-dioxopyrrolidin-1-yl 1-(4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy)-3,6,9,12-tetraoxapentadecan-15-oate
Purity	95%
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Canonical SMILES	CC1=NN=C(N=N1)C2=CC=C(C=C2)OCCOCCOCCOCCOCCC(=O)ON3C(=O)CCC3=O
InChI	InChI=1S/C24H31N5O9/c1-18-25-27-24(28-26-18)19-2-4-20(5-3-19)37-17-16-36-15-14-35-13-12-34-11-10-33-9-8-23(32)38-29-21(30)6-7-22(29)31/h2-5H,6-17H2,1H3
InChI Key	SWSUSQWZOPGVKP-UHFFFAOYSA-N
Solubility	Poorly soluble

Storage

Please store the product under the recommended conditions in the Certificate of Analysis.

Computed Properties
XLogP3	-1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	13
Rotatable Bond Count	19
Exact Mass	533.21217758 g/mol
Monoisotopic Mass	533.21217758 g/mol
Topological Polar Surface Area	161Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	699
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Publication Number	Title	Priority Date
US-2020123193-A1	Charge-tagged nucleotides and methods of use thereof	2018-02-16
US-10851131-B2	Charge-tagged nucleotides and methods of use thereof	2018-02-16
US-2021179657-A1	Charge-tagged nucleotides and methods of use thereof	2018-02-16

Applications of Fluorescent Probes & Dyes

Laser Dye

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