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Lenalidomide 4'-alkyl-C5-azide

CAT: 0931-T84910-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T84910-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2399455-78-6
Target
Others, E3 Ligase Ligand-Linker Conjugate
Related Pathways
PROTAC, Others
Bioactivity
Lenalidomide 4'-alkyl-C5-azide, a functionalized cerebellar ligand designed for PROTAC development, comprises an E3 ligand and an alkyl LC5 ligand featuring terminal azides for coupling with a target protein ligand [1].
Smiles
N(CCCCCN=[N+]=[N-])C1=C2C(C(=O)N(C2)C3C(=O)NC(=O)CC3)=CC=C1
Molecular Formula
C18H22N6O3
Molecular Weight
370.41
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Lenalidomide 4'-alkyl-C5-azide
CAS Number2399455-78-6
PubChem CID151825887
IUPAC Name3-[7-(5-azidopentylamino)-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione
Molecular FormulaC18H22N6O3
Molecular Weight370.4
XLogP2.1
Topological Polar Surface Area92.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count27
Formal Charge0
Complexity633
SMILES
C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC=C3NCCCCCN=[N+]=[N-]
InChI
InChI=1S/C18H22N6O3/c19-23-21-10-3-1-2-9-20-14-6-4-5-12-13(14)11-24(18(12)27)15-7-8-16(25)22-17(15)26/h4-6,15,20H,1-3,7-11H2,(H,22,25,26)
InChIKey
SDPGTOOVIBSDST-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lenalidomide 4'-alkyl-C5-azide
CAS: 2399455-78-6
CID: 151825887
Formula: C18H22N6O3
MW: 370.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight370.4
XLogP32.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass370.17533859
Monoisotopic Mass370.17533859
Topological Polar Surface Area92.9 Ų
Heavy Atom Count27
Formal Charge0
Complexity633
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-161132-01Lenalidomide 4'-alkyl-C5-azide
HY-161131Lenalidomide 4'-alkyl-C3-azide
MBS5765713C5 Lenalidomide
GTR19225563-01Lenalidomide-C5-NH2
HY-160241-01Lenalidomide-C5-acid
HY-W586819C5 Lenalidomide-CH3
7513/25Lenalidomide 4'-PEG1-azide
7516/25Lenalidomide 4'-alkylC3-azide
7514/25Lenalidomide 4'-PEG2-azide
7517/25Lenalidomide 4'-alkylC5-azide

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