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Thalidomide-piperidine

CAT: 0013-GTR19239293-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19239293-01Size:50 mg
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Description
Thalidomide-piperidine is a bifunctional PROTAC component that serves as an E3 ligase ligand-linker conjugate, specifically for cereblon. It is widely used in PROTAC synthesis for targeted protein degradation research, facilitating the study of protein function in both cellular and animal models.
CAS Number
2924858-38-6
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C1NC (=O) C (N2C (=O) C3=CC=CC (=C3C2=O) N4CCCCC4) CC1
Molecular Formula
C18H19N3O4
Molecular Weight
341.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Thalidomide-piperidine
CAS Number2924858-38-6
PubChem CID159182694
IUPAC Name2-(2,6-dioxopiperidin-3-yl)-4-piperidin-1-ylisoindole-1,3-dione
Molecular FormulaC18H19N3O4
Molecular Weight341.4
XLogP1.3
Topological Polar Surface Area86.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count25
Formal Charge0
Complexity613
SMILES
C1CCN(CC1)C2=CC=CC3=C2C(=O)N(C3=O)C4CCC(=O)NC4=O
InChI
InChI=1S/C18H19N3O4/c22-14-8-7-13(16(23)19-14)21-17(24)11-5-4-6-12(15(11)18(21)25)20-9-2-1-3-10-20/h4-6,13H,1-3,7-10H2,(H,19,22,23)
InChIKey
GXLMQGTZIWFZLM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Thalidomide-piperidine
CAS: 2924858-38-6
CID: 159182694
Formula: C18H19N3O4
MW: 341.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight341.4
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass341.13755610
Monoisotopic Mass341.13755610
Topological Polar Surface Area86.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity613
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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HY-169050Thalidomide-piperidine
HY-W584986Thalidomide- (2) piperidine
HY-138783Thalidomide-Piperazine-Piperidine
HY-W998319Thalidomide-piperidine-O-piperidine (dihydrochloride)
HY-161202Thalidomide-piperidine-O-piperidine-C2-OH
HY-176227Thalidomide-piperidine-azetidine-Br
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