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CRBN ligand-360

CAT: 0804-HY-W953306Size: 1 EachDry Ice: NoHazardous: No
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Description
CRBN ligand-360 is an E3 ubiquitin ligase cereblon (CRBN) ligand used to recruit the cereblon protein. CRBN ligand-360 can be linked to a target protein ligand via a linker to form a PROTAC.
CAS Number
2925089-29-6
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Ligands for E3 Ligase
Related Pathways
PROTAC
Field of Research
Cancer
Smiles
O=C1NC(=O)CCN1C=2C=C(N)C=3NN=CC3C2
Molecular Formula
C11H11N5O2
Molecular Weight
245.24
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Cereblon

Chemical Information

1-(7-amino-1H-indazol-5-yl)-1,3-diazinane-2,4-dione
CAS Number2925089-29-6
PubChem CID169548441
IUPAC Name1-(7-amino-1H-indazol-5-yl)-1,3-diazinane-2,4-dione
Molecular FormulaC11H11N5O2
Molecular Weight245.24
XLogP-0.5
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count18
Formal Charge0
Complexity374
SMILES
C1CN(C(=O)NC1=O)C2=CC3=C(C(=C2)N)NN=C3
InChI
InChI=1S/C11H11N5O2/c12-8-4-7(3-6-5-13-15-10(6)8)16-2-1-9(17)14-11(16)18/h3-5H,1-2,12H2,(H,13,15)(H,14,17,18)
InChIKey
KYULNMHGTDIMLI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(7-amino-1H-indazol-5-yl)-1,3-diazinane-2,4-dione
CAS: 2925089-29-6
CID: 169548441
Formula: C11H11N5O2
MW: 245.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.24
XLogP3-0.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass245.09127461
Monoisotopic Mass245.09127461
Topological Polar Surface Area104 Ų
Heavy Atom Count18
Formal Charge0
Complexity374
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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