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CRBN ligand-883

CAT: 0804-HY-W886312Size: 1 EachDry Ice: NoHazardous: No
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Description
CRBN ligand-883 is an E3 ubiquitin ligase cereblon (CRBN) ligand used to recruit the cereblon protein. CRBN ligand-883 can be linked to a target protein ligand via a linker to form a PROTAC.
CAS Number
1502483-16-0
UNSPSC
12352005
Hazard Statement
H302-H315-H319
Target
Ligands for E3 Ligase
Related Pathways
PROTAC
Field of Research
Cancer
Smiles
O=C(O)C1=CC=CC(=C1)C2C(=O)NC(=O)CC2
Molecular Formula
C12H11NO4
Molecular Weight
233.22
Precautions
P264-P270-P280-P302+P352-P305+P351+P338-P330-P362+P364-P501
Shipping Conditions
Room temperature
Scientific Category
Reference compound2
Clinical Information
No Development Reported
Isoform
Cereblon

Chemical Information

3-(2,6-Dioxo-3-piperidyl)benzoic acid
CAS Number1502483-16-0
PubChem CID82619843
IUPAC Name3-(2,6-dioxopiperidin-3-yl)benzoic acid
Molecular FormulaC12H11NO4
Molecular Weight233.22
XLogP0.5
Topological Polar Surface Area83.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity352
SMILES
C1CC(=O)NC(=O)C1C2=CC(=CC=C2)C(=O)O
InChI
InChI=1S/C12H11NO4/c14-10-5-4-9(11(15)13-10)7-2-1-3-8(6-7)12(16)17/h1-3,6,9H,4-5H2,(H,16,17)(H,13,14,15)
InChIKey
PIPKGCPSFYBQHO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(2,6-Dioxo-3-piperidyl)benzoic acid
CAS: 1502483-16-0
CID: 82619843
Formula: C12H11NO4
MW: 233.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight233.22
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass233.06880783
Monoisotopic Mass233.06880783
Topological Polar Surface Area83.5 Ų
Heavy Atom Count17
Formal Charge0
Complexity352
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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