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Azide-PEG3-Desthiobiotin

CAT: 1410-M35075-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Azide-PEG3-Desthiobiotin is a PROTAC linker belonging to the PEG class and can be used to synthesize PROTAC molecules.
CAS Number
1426828-06-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
414.5
Molecular Formula
C18H34N6O5
Notes
Research use only, not for human use.
Receptor
Others

Chemical Information

Azide-PEG3-Desthiobiotin
CAS Number1426828-06-9
PubChem CID91757902
IUPAC NameN-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]-6-[(4R,5S)-5-methyl-2-oxoimidazolidin-4-yl]hexanamide
Molecular FormulaC18H34N6O5
Molecular Weight414.5
XLogP1
Topological Polar Surface Area112
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Heavy Atom Count29
Formal Charge0
Complexity515
SMILES
C[C@H]1[C@H](NC(=O)N1)CCCCCC(=O)NCCOCCOCCOCCN=[N+]=[N-]
InChI
InChI=1S/C18H34N6O5/c1-15-16(23-18(26)22-15)5-3-2-4-6-17(25)20-7-9-27-11-13-29-14-12-28-10-8-21-24-19/h15-16H,2-14H2,1H3,(H,20,25)(H2,22,23,26)/t15-,16+/m0/s1
InChIKey
JIQVKRRASYKCEL-JKSUJKDBSA-N
Chemical Structure
2D Structure
2D structure of Azide-PEG3-Desthiobiotin
CAS: 1426828-06-9
CID: 91757902
Formula: C18H34N6O5
MW: 414.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight414.5
XLogP31
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count18
Exact Mass414.25906821
Monoisotopic Mass414.25906821
Topological Polar Surface Area112 Ų
Heavy Atom Count29
Formal Charge0
Complexity515
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes