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Pomalidomide-C2-NH2 10mg

CAT: 0628-A18855-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0628-A18855-10Size:10 mg
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CAS Number
1957235-66-3

Chemical Information

Pomalidomide-C2-NH2
CAS Number1957235-66-3
PubChem CID44571923
IUPAC Name4-(2-aminoethylamino)-2-(2,6-dioxopiperidin-3-yl)isoindole-1,3-dione
Molecular FormulaC15H16N4O4
Molecular Weight316.31
XLogP-0.1
Topological Polar Surface Area122
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity550
SMILES
C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NCCN
InChI
InChI=1S/C15H16N4O4/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)
InChIKey
WYIGFEKILOYHCT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pomalidomide-C2-NH2
CAS: 1957235-66-3
CID: 44571923
Formula: C15H16N4O4
MW: 316.31
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight316.31
XLogP3-0.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass316.11715500
Monoisotopic Mass316.11715500
Topological Polar Surface Area122 Ų
Heavy Atom Count23
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 Count1
Compound Is CanonicalizedYes