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Belinostat Amide

CAT: 0572-TRC-B131480-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-B131480-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1485081-57-9
Synonyms
(2E)-3-[3-[(Phenylamino)sulfonyl]phenyl]-2-propenamide
Hazard Statement
No Data Available
Purity
>95% (HPLC)
Smiles
NC(=O)\C=C\c1cccc(c1)S(=O)(=O)Nc2ccccc2
Molecular Formula
C15H14N2O3S
Molecular Weight
302.35
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Belinostat amide
CAS Number1485081-57-9
PubChem CID69620795
IUPAC Name(E)-3-[3-(phenylsulfamoyl)phenyl]prop-2-enamide
Molecular FormulaC15H14N2O3S
Molecular Weight302.4
XLogP1.7
Topological Polar Surface Area97.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count21
Formal Charge0
Complexity476
SMILES
C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)/C=C/C(=O)N
InChI
InChI=1S/C15H14N2O3S/c16-15(18)10-9-12-5-4-8-14(11-12)21(19,20)17-13-6-2-1-3-7-13/h1-11,17H,(H2,16,18)/b10-9+
InChIKey
LUVPQDAKKRMIOY-MDZDMXLPSA-N
Chemical Structure
2D Structure
2D structure of Belinostat amide
CAS: 1485081-57-9
CID: 69620795
Formula: C15H14N2O3S
MW: 302.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight302.4
XLogP31.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass302.07251349
Monoisotopic Mass302.07251349
Topological Polar Surface Area97.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity476
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes