Bis-PEG2-endo-BCN

CAT: 0931-T14631Size: 2 mgDry Ice: NoHazardous: No

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CAT#:0931-T14631Size:2 mg

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CAS Number

1476737-97-9

Target

ADC Linker

Related Pathways

Antibody-drug Conjugate/ADC Related

Bioactivity

Bis-PEG2-endo-BCN is a two-unit cleavable polyethylene glycol (PEG) linker employed in the synthesis of antibody-drug conjugates (ADCs) [1].

Smiles

[H][C@@]12CCC#CCC[C@]1([H])C2COC(=O)NCCOCCOCCNC(=O)OCC1[C@]2([H])CCC#CCC[C@]12[H]

Molecular Formula

C28H40N2O6

Molecular Weight

500.636

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

bis-PEG2-endo-BCN

CAS Number	1476737-97-9
PubChem CID	98813933
IUPAC Name	[(1R,8S)-9-bicyclo[6.1.0]non-4-ynyl]methyl N-[2-[2-[2-[[(1R,8S)-9-bicyclo[6.1.0]non-4-ynyl]methoxycarbonylamino]ethoxy]ethoxy]ethyl]carbamate
Molecular Formula	C28H40N2O6
Molecular Weight	500.6
XLogP	4.1
Topological Polar Surface Area	95.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	15
Heavy Atom Count	36
Formal Charge	0
Complexity	771

SMILES

C1C[C@@H]2[C@@H](C2COC(=O)NCCOCCOCCNC(=O)OCC3[C@H]4[C@@H]3CCC#CCC4)CCC#C1

InChI

InChI=1S/C28H40N2O6/c31-27(35-19-25-21-9-5-1-2-6-10-22(21)25)29-13-15-33-17-18-34-16-14-30-28(32)36-20-26-23-11-7-3-4-8-12-24(23)26/h21-26H,5-20H2,(H,29,31)(H,30,32)/t21-,22+,23-,24+,25?,26?

InChIKey

NISHVKOYJUQOBR-ICFBRBJFSA-N

Chemical Structure

2D Structure

CAS: 1476737-97-9

CID: 98813933

Formula: C28H40N2O6

MW: 500.6

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	500.6
XLogP3	4.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	15
Exact Mass	500.28863700
Monoisotopic Mass	500.28863700
Topological Polar Surface Area	95.1 Å²
Heavy Atom Count	36
Formal Charge	0
Complexity	771
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
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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T17625	Bis-PEG23-endo-BCN
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T15222-01	Endo-BCN-PEG2-alcohol
TCL-02002-01	Endo-BCN-PEG2-Biotin
T15221-01	Endo-BCN-PEG2-acid
T82659-01	Cy3-PEG2-endo-BCN
T15223-01	Endo-BCN-PEG2-PFP ester
T206829-01	Endo-BCN-PEG2-NHS ester

Alternative Products

Catalog	Name
BJC73797-01	Bis-PEG2-endo-BCN
MD253253-2	endo-BCN-PEG2-endo-BCN
571762	endo-BCN-PEG2-alcohol
MD253002-2	endo-BCN-PEG2-OH
GTR19222473-01	Endo-BCN-PEG2-NH2
571749	endo-BCN-PEG2-acid
MBS5824309	Cy3-PEG2-endo-BCN
GTR19265656-01	Endo-BCN-PEG2-Biotin
HY-156311-01	BCN-endo-PEG2-maleimide

Bis-PEG2-endo-BCN

Chemical Information

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