Products for Research Use Only

DNP-PEG3-DNP

CAT: 0013-GTR19226990-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19226990-01Size:100 mg
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Description
DNP-PEG3-DNP is a heterobifunctional PEG linker used to construct PROTAC molecules for targeted protein degradation. It connects a target protein ligand to an E3 ubiquitin ligase recruiter, enabling the study of protein function via the ubiquitin-proteasome system in both cellular and biochemical assays.
CAS Number
1365655-92-0
Field of Research
Cell Biology, Pharmacology & Drug Discovery
Smiles
O=N (=O) C1=CC=C (NCCOCCOCCOCCNC2=CC=C (C=C2N (=O) =O) N (=O) =O) C (=C1) N (=O) =O
Molecular Formula
C20H24N6O11
Molecular Weight
524.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dnp-peg3-dnp
CAS Number1365655-92-0
PubChem CID60146193
IUPAC NameN-[2-[2-[2-[2-(2,4-dinitroanilino)ethoxy]ethoxy]ethoxy]ethyl]-2,4-dinitroaniline
Molecular FormulaC20H24N6O11
Molecular Weight524.4
XLogP3.6
Topological Polar Surface Area235
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count13
Rotatable Bond Count14
Heavy Atom Count37
Formal Charge0
Complexity678
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCOCCOCCOCCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C20H24N6O11/c27-23(28)15-1-3-17(19(13-15)25(31)32)21-5-7-35-9-11-37-12-10-36-8-6-22-18-4-2-16(24(29)30)14-20(18)26(33)34/h1-4,13-14,21-22H,5-12H2
InChIKey
DCJHARRKAIYZFB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dnp-peg3-dnp
CAS: 1365655-92-0
CID: 60146193
Formula: C20H24N6O11
MW: 524.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight524.4
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count13
Rotatable Bond Count14
Exact Mass524.15030560
Monoisotopic Mass524.15030560
Topological Polar Surface Area235 Ų
Heavy Atom Count37
Formal Charge0
Complexity678
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