BCN-endo-PEG4-NHS

CAT: 0931-T84849-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0931-T84849-01Size:10 mg

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CAS Number

1702356-19-1

Target

ADC Linker

Related Pathways

Antibody-drug Conjugate/ADC Related

Bioactivity

BCN-endo-PEG4-NHS is an ADC linker comprising 4 polyethylene glycol (PEG) units and features the lyophilic bidentate macrocyclic ligand, endo-BCN. This structure enables the synthesis of macrocyclic complexes and allows endo-BCN to engage in click chemistry reactions with azide-group-containing molecules to form stable triazoles without the need for catalysts.

Smiles

C(OCCOCCNC(=O)OC[C@@H]1[C@@]2([H])[C@]1([H])CCC#CCC2)COCCOCCC(=O)ON3C(=O)CCC3=O

Molecular Formula

C26H38N2O10

Molecular Weight

538.5858

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

BCN-PEG4-NHS ester

CAS Number	1702356-19-1
PubChem CID	121242067
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[[(1S,8R)-9-bicyclo[6.1.0]non-4-ynyl]methoxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular Formula	C26H38N2O10
Molecular Weight	538.6
XLogP	0.7
Topological Polar Surface Area	139
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	20
Heavy Atom Count	38
Formal Charge	0
Complexity	833

SMILES

C1C[C@@H]2[C@@H](C2COC(=O)NCCOCCOCCOCCOCCC(=O)ON3C(=O)CCC3=O)CCC#C1

InChI

InChI=1S/C26H38N2O10/c29-23-7-8-24(30)28(23)38-25(31)9-11-33-13-15-35-17-18-36-16-14-34-12-10-27-26(32)37-19-22-20-5-3-1-2-4-6-21(20)22/h20-22H,3-19H2,(H,27,32)/t20-,21+,22?

InChIKey

MFQCOKMBYCIQEJ-CBQGHPETSA-N

Chemical Structure

2D Structure

CAS: 1702356-19-1

CID: 121242067

Formula: C26H38N2O10

MW: 538.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	538.6
XLogP3	0.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	20
Exact Mass	538.25264541
Monoisotopic Mass	538.25264541
Topological Polar Surface Area	139 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	833
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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T15228-01	Endo-BCN-PEG4-NHS ester
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T17937-01	Endo-BCN-PEG3-NHS ester
TCL-01759-01	Endo-BCN-PEG4-Pomalidomide
T15227-01	Endo-BCN-PEG4-Boc
TCL-01764-01	Endo-BCN-PEG4-Palmitic
T15226-01	Endo-BCN-PEG4-acid
T87919-01	BCN-exo-PEG4-NHS
T17536	BCN-PEG4-NHS ester

Alternative Products

Catalog	Name
BA2525-50	BCN-endo-PEG4-NHS
OR1038148-01	Endo-BCN-PEG4-NHS ester
HY-W879031	Endo-BCN-PEG4-Palmitic
HY-135971-01	Endo-BCN-PEG4-acid
MBS5769037	endo-BCN-PEG4-Boc
BIPG2500-01	Endo-BCN-PEG4-amine
HY-W879032	Endo-BCN-PEG4-Pomalidomide
CTC35619	BCN-endo-PEG4-SPA
MD253067-4	endo-BCN-PEG4-CH2CH2COOtBu

BCN-endo-PEG4-NHS

Chemical Information

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