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SY2-062

CAT: 0013-GTR19170071-04Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19170071-04Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
This small molecule, 4-bromo-2- (2,6-dioxopiperidin-3-yl) isoindoline-1,3-dione, is a multi-target research compound with potential applications in oncology, neurobiology, and immunology. It functions as a cereblon modulator, enabling its study in targeted protein degradation for cancer and in vitro models of neuroinflammation relevant to Parkinson's disease.
CAS Number
2093536-12-8
Product Name Alternative
4Bromo2 (2,6dioxopiperidin3yl) isoindoline1,3dione, 4-Bromo-2- (2,6-dioxopiperidin-3-yl) isoindoline-1,3-dione, 4 Bromo 2 (2,6 dioxopiperidin 3 yl) isoindoline 1,3 dione
Purity
96.62% (May vary between batches)
Smiles
O=C1N (C (=O) C=2C1=CC=CC2Br) C3C (=O) NC (=O) CC3
Molecular Formula
C13H9BrN2O4
Molecular Weight
337.13
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-bromo-2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione
CAS Number2093536-12-8
PubChem CID131999631
IUPAC Name4-bromo-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
Molecular FormulaC13H9BrN2O4
Molecular Weight337.12
XLogP1
Topological Polar Surface Area83.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity507
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)Br
InChI
InChI=1S/C13H9BrN2O4/c14-7-3-1-2-6-10(7)13(20)16(12(6)19)8-4-5-9(17)15-11(8)18/h1-3,8H,4-5H2,(H,15,17,18)
InChIKey
NUICQRZENMKDBW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-bromo-2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione
CAS: 2093536-12-8
CID: 131999631
Formula: C13H9BrN2O4
MW: 337.12
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight337.12
XLogP31
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass335.97457
Monoisotopic Mass335.97457
Topological Polar Surface Area83.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity507
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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