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BNTA

CAT: 1410-M35227-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M35227-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BNTA is a potent extracellular matrix (ECM) modulator. In a rat model of arthritis, BNTA modulates arthritis by promoting the synthesis of cartilage structural molecules on chondrocytes through the induction of superoxide dismutase 3 (SOD3) and regulating chondrogenesis through superoxide anion elimination.
CAS Number
685119-25-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
456.76
Molecular Formula
C17H11BrClNO3S2
Notes
Research use only, not for human use.
Receptor
Reactive Oxygen Species

Chemical Information

N-(2-bromo-4-(phenylsulfonyl)thiophen-3-yl)-2-chlorobenzamide
CAS Number685119-25-9
PubChem CID2819453
IUPAC NameN-[4-(benzenesulfonyl)-2-bromothiophen-3-yl]-2-chlorobenzamide
Molecular FormulaC17H11BrClNO3S2
Molecular Weight456.8
XLogP5.4
Topological Polar Surface Area99.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity577
SMILES
C1=CC=C(C=C1)S(=O)(=O)C2=CSC(=C2NC(=O)C3=CC=CC=C3Cl)Br
InChI
InChI=1S/C17H11BrClNO3S2/c18-16-15(20-17(21)12-8-4-5-9-13(12)19)14(10-24-16)25(22,23)11-6-2-1-3-7-11/h1-10H,(H,20,21)
InChIKey
OCNJYMSNHNAZON-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2-bromo-4-(phenylsulfonyl)thiophen-3-yl)-2-chlorobenzamide
CAS: 685119-25-9
CID: 2819453
Formula: C17H11BrClNO3S2
MW: 456.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight456.8
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass454.90523
Monoisotopic Mass454.90523
Topological Polar Surface Area99.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity577
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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