Amino-PEG27-amine

CAT: 0804-HY-133330Size: 1 EachDry Ice: NoHazardous: No

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CAT#:0804-HY-133330Size:1 Each

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Description

Amino-PEG27-amine is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].

CAS Number

2252208-09-4

Product Name Alternative

H2N-PEG27-CH2CH2NH2

UNSPSC

12352211

Hazard Statement

H302-H315-H319-H335

Target

PROTAC Linkers

Type

Reference compound

Related Pathways

PROTAC

Applications

Cancer-programmed cell death

Field of Research

Cancer

Assay Protocol

https://www.medchemexpress.com/amino-peg27-amine.html

Solubility

10 mM in DMSO

Smiles

NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN

Molecular Formula

C56H116N2O27

Molecular Weight

1249.52

Precautions

P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

References & Citations

[1]An S, et al. Small-molecule PROTACs: An emerging and promising approach for the development of targeted therapy drugs. EBioMedicine. 2018 Oct;36:553-562

Shipping Conditions

Room temperature

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Isoform

PEG Linkers

Chemical Information

Amino-PEG27-amine

CAS Number	2252208-09-4
PubChem CID	112758640
IUPAC Name	2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
Molecular Formula	C56H116N2O27
Molecular Weight	1249.5
XLogP	-5.6
Topological Polar Surface Area	301
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	29
Rotatable Bond Count	82
Heavy Atom Count	85
Formal Charge	0
Complexity	1030

SMILES

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN)N

InChI

InChI=1S/C56H116N2O27/c57-1-3-59-5-7-61-9-11-63-13-15-65-17-19-67-21-23-69-25-27-71-29-31-73-33-35-75-37-39-77-41-43-79-45-47-81-49-51-83-53-55-85-56-54-84-52-50-82-48-46-80-44-42-78-40-38-76-36-34-74-32-30-72-28-26-70-24-22-68-20-18-66-16-14-64-12-10-62-8-6-60-4-2-58/h1-58H2

InChIKey

KGMAXTLPFBXOND-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2252208-09-4

CID: 112758640

Formula: C56H116N2O27

MW: 1249.5

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1249.5
XLogP3	-5.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	29
Rotatable Bond Count	82
Exact Mass	1248.77654643
Monoisotopic Mass	1248.77654643
Topological Polar Surface Area	301 Å²
Heavy Atom Count	85
Formal Charge	0
Complexity	1030
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

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Alternative Products

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T17425-01	Amino-PEG27-amine
abx085137	NH2-PEG27-CH2CH2COOH
571832	Amino-PEG5-amine
571830	Amino-PEG3-amine
T14254-01	Amino-PEG9-amine
T17419-01	Amino-PEG23-amine
T17407-01	Amino-PEG12-amine
MBS3615496-01	Amino-PEG13-amine
BUP15950-01	Amino-PEG8-amine
BIPG1058-01	Amino-PEG7-Amine

Amino-PEG27-amine

Chemical Information

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