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Pomalidomide-PEG2-azide

CAT: 0127-OR1001802-02Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1001802-02Size:100 mg
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CAS Number
2267306-14-7
Purity
95%
Smiles
O=C(NC1=CC=CC(C(N2C(CC3)C(NC3=O)=O)=O)=C1C2=O)COCCOCCN=[N+]=[N-]

Chemical Information

Pomalidomide-PEG2-azide
CAS Number2267306-14-7
PubChem CID155292127
IUPAC Name2-[2-(2-azidoethoxy)ethoxy]-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]acetamide
Molecular FormulaC19H20N6O7
Molecular Weight444.4
XLogP0.5
Topological Polar Surface Area145
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Heavy Atom Count32
Formal Charge0
Complexity827
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)COCCOCCN=[N+]=[N-]
InChI
InChI=1S/C19H20N6O7/c20-24-21-6-7-31-8-9-32-10-15(27)22-12-3-1-2-11-16(12)19(30)25(18(11)29)13-4-5-14(26)23-17(13)28/h1-3,13H,4-10H2,(H,22,27)(H,23,26,28)
InChIKey
QMQAWNMGKYQDLT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pomalidomide-PEG2-azide
CAS: 2267306-14-7
CID: 155292127
Formula: C19H20N6O7
MW: 444.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.4
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count10
Exact Mass444.13934700
Monoisotopic Mass444.13934700
Topological Polar Surface Area145 Ų
Heavy Atom Count32
Formal Charge0
Complexity827
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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