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CRBN ligand-388

CAT: 0013-GTR19275436-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19275436-01Size:10 mg
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Description
CRBN ligand-388 is a ligand for the E3 ubiquitin ligase cereblon (CRBN), designed to recruit cereblon protein. By using a linker, CRBN ligand-388 can be attached to a target protein ligand to form a PROTAC.
CAS Number
2925072-35-9
Smiles
O=C1NC (=O) CCN1C2=CC=CC=3C (=NNC32) N
Molecular Formula
C11H11N5O2
Molecular Weight
245.24
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(3-amino-1H-indazol-7-yl)-1,3-diazinane-2,4-dione
CAS Number2925072-35-9
PubChem CID169548434
IUPAC Name1-(3-amino-1H-indazol-7-yl)-1,3-diazinane-2,4-dione
Molecular FormulaC11H11N5O2
Molecular Weight245.24
XLogP-0.1
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=CC=CC3=C2NN=C3N
InChI
InChI=1S/C11H11N5O2/c12-10-6-2-1-3-7(9(6)14-15-10)16-5-4-8(17)13-11(16)18/h1-3H,4-5H2,(H3,12,14,15)(H,13,17,18)
InChIKey
OFEIQJXYQYTZKK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(3-amino-1H-indazol-7-yl)-1,3-diazinane-2,4-dione
CAS: 2925072-35-9
CID: 169548434
Formula: C11H11N5O2
MW: 245.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.24
XLogP3-0.1
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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