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CRBN ligand-210

CAT: 0804-HY-W996314-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-W996314-01Size:25 mg
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Description
CRBN ligand-210 is an E3 ubiquitin ligase cereblon (CRBN) ligand used to recruit the cereblon protein. CRBN ligand-210 can be linked to a target protein ligand via a linker to form a PROTAC.
CAS Number
79987-78-3
UNSPSC
12352005
Hazard Statement
H302-H315-H319
Target
Ligands for E3 Ligase
Related Pathways
PROTAC
Field of Research
Cancer
Smiles
O=C1N(C(=O)C(C=2C=CC=C(O)C2)CC1)CC=3C=CC=CC3
Molecular Formula
C18H17NO3
Molecular Weight
295.34
Precautions
P264-P270-P280-P302+P352-P305+P351+P338-P330-P362+P364-P501
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Cereblon

Chemical Information

1-Benzyl-3-(3-hydroxyphenyl)piperidine-2,6-dione
CAS Number79987-78-3
PubChem CID12946738
IUPAC Name1-benzyl-3-(3-hydroxyphenyl)piperidine-2,6-dione
Molecular FormulaC18H17NO3
Molecular Weight295.3
XLogP2.3
Topological Polar Surface Area57.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity417
SMILES
C1CC(=O)N(C(=O)C1C2=CC(=CC=C2)O)CC3=CC=CC=C3
InChI
InChI=1S/C18H17NO3/c20-15-8-4-7-14(11-15)16-9-10-17(21)19(18(16)22)12-13-5-2-1-3-6-13/h1-8,11,16,20H,9-10,12H2
InChIKey
VDQYMEUOWOWQNG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Benzyl-3-(3-hydroxyphenyl)piperidine-2,6-dione
CAS: 79987-78-3
CID: 12946738
Formula: C18H17NO3
MW: 295.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight295.3
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass295.12084340
Monoisotopic Mass295.12084340
Topological Polar Surface Area57.6 Ų
Heavy Atom Count22
Formal Charge0
Complexity417
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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