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Pomalidomide-C2-NH2 hydrochloride

CAT: 0013-GTR19155864-01Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19155864-01Size:200 mg
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Description
Pomalidomide-C2-NH2 hydrochloride is a synthesized E3 ligase ligand-linker conjugate that incorporates the Pomalidomide based cereblon ligand and a linker used in PROTAC technology.
CAS Number
2305369-00-8
Field of Research
Pharmacology & Drug Discovery
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 125 mg/mL (354.34 mM)
Smiles
O=C1N (C (CC2) C (NC2=O) =O) C (C3=C1C=CC=C3NCCN) =O.[H]Cl
Molecular Formula
C15H17ClN4O4
Molecular Weight
352.77
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Pomalidomide-C2-NH2 hydrochloride
CAS Number2305369-00-8
PubChem CID139035073
IUPAC Name4-(2-aminoethylamino)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione;hydrochloride
Molecular FormulaC15H17ClN4O4
Molecular Weight352.77
Topological Polar Surface Area122
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity550
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NCCN.Cl
InChI
InChI=1S/C15H16N4O4.ClH/c16-6-7-17-9-3-1-2-8-12(9)15(23)19(14(8)22)10-4-5-11(20)18-13(10)21;/h1-3,10,17H,4-7,16H2,(H,18,20,21);1H
InChIKey
DSJCOXQYDMWPEY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pomalidomide-C2-NH2 hydrochloride
CAS: 2305369-00-8
CID: 139035073
Formula: C15H17ClN4O4
MW: 352.77
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.77
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass352.0938327
Monoisotopic Mass352.0938327
Topological Polar Surface Area122 Ų
Heavy Atom Count24
Formal Charge0
Complexity550
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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