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CRBN ligand-315

CAT: 0013-GTR19276077-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19276077-01Size:50 mg
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Description
CRBN ligand-315 is an E3 ubiquitin ligase cereblon (CRBN) ligand designed for recruiting cereblon proteins. It can be linked via a linker to a target protein ligand to form a PROTAC.
CAS Number
2925081-83-8
Smiles
O=C1NC (=O) CCN1C=2C=C (Br) C=3N=CN=CC3C2
Molecular Formula
C12H9BrN4O2
Molecular Weight
321.13
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(8-Bromoquinazolin-6-yl)-1,3-diazinane-2,4-dione
CAS Number2925081-83-8
PubChem CID169548884
IUPAC Name1-(8-bromoquinazolin-6-yl)-1,3-diazinane-2,4-dione
Molecular FormulaC12H9BrN4O2
Molecular Weight321.13
XLogP0.9
Topological Polar Surface Area75.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count19
Formal Charge0
Complexity392
SMILES
C1CN(C(=O)NC1=O)C2=CC3=CN=CN=C3C(=C2)Br
InChI
InChI=1S/C12H9BrN4O2/c13-9-4-8(3-7-5-14-6-15-11(7)9)17-2-1-10(18)16-12(17)19/h3-6H,1-2H2,(H,16,18,19)
InChIKey
CXLYPLFLFYQNOB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(8-Bromoquinazolin-6-yl)-1,3-diazinane-2,4-dione
CAS: 2925081-83-8
CID: 169548884
Formula: C12H9BrN4O2
MW: 321.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight321.13
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass319.99089
Monoisotopic Mass319.99089
Topological Polar Surface Area75.2 Ų
Heavy Atom Count19
Formal Charge0
Complexity392
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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