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Desamino lenalidomide-cyano

CAT: 0804-HY-W580776-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W580776-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Desamino lenalidomide-cyano is an E3 ubiquitin ligase cereblon (CRBN) ligand used to recruit the cereblon protein. Desamino lenalidomide-cyano can be linked to a target protein ligand via a linker to form a PROTAC.
CAS Number
2639386-82-4
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Ligands for E3 Ligase
Related Pathways
PROTAC
Field of Research
Cancer
Purity
99.91
Smiles
N#CC1=CC=C2C(=C1)C(=O)N(C2)C3C(=O)NC(=O)CC3
Molecular Formula
C14H11N3O3
Molecular Weight
269.26
Precautions
H302, H315, H319, H335
Shipping Conditions
Room Temperature
Storage Conditions
Store at room temperature 3 years
Scientific Category
Reference compound2
Clinical Information
No Development Reported
Isoform
Cereblon

Chemical Information

2-(2,6-Dioxopiperidin-3-yl)-3-oxoisoindoline-5-carbonitrile
CAS Number2639386-82-4
PubChem CID156249214
IUPAC Name2-(2,6-dioxopiperidin-3-yl)-3-oxo-1H-isoindole-5-carbonitrile
Molecular FormulaC14H11N3O3
Molecular Weight269.25
XLogP-0.1
Topological Polar Surface Area90.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity521
SMILES
C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=C(C=C3)C#N
InChI
InChI=1S/C14H11N3O3/c15-6-8-1-2-9-7-17(14(20)10(9)5-8)11-3-4-12(18)16-13(11)19/h1-2,5,11H,3-4,7H2,(H,16,18,19)
InChIKey
AABCQCXLKZIUFW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(2,6-Dioxopiperidin-3-yl)-3-oxoisoindoline-5-carbonitrile
CAS: 2639386-82-4
CID: 156249214
Formula: C14H11N3O3
MW: 269.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight269.25
XLogP3-0.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass269.08004122
Monoisotopic Mass269.08004122
Topological Polar Surface Area90.3 Ų
Heavy Atom Count20
Formal Charge0
Complexity521
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
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