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Orazipone

CAT: 0013-GTR19209005-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209005-02Size:50 mg
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Description
Orazipone is a non-steroidal anti-inflammatory drug (NSAID) that suppresses cytokine production and inhibits histamine release. It is utilized in research to study inflammatory and allergic responses in both in vitro cellular assays and in vivo experimental models.
CAS Number
137109-78-5
Smiles
S (C) (=O) (=O) C1=CC=C (C=C (C (C) =O) C (C) =O) C=C1
Molecular Formula
C13H14O4S
Molecular Weight
266.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Orazipone

Orazipone is a small molecule drug. Orazipone has a monoisotopic molecular weight of 266.06 Da.

CAS Number137109-78-5
PubChem CID178387
IUPAC Name3-[(4-methylsulfonylphenyl)methylidene]pentane-2,4-dione
Molecular FormulaC13H14O4S
Molecular Weight266.31
XLogP0.9
Topological Polar Surface Area76.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity444
SMILES
CC(=O)C(=CC1=CC=C(C=C1)S(=O)(=O)C)C(=O)C
InChI
InChI=1S/C13H14O4S/c1-9(14)13(10(2)15)8-11-4-6-12(7-5-11)18(3,16)17/h4-8H,1-3H3
InChIKey
CAWYWWPWSAMGBV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Orazipone
CAS: 137109-78-5
CID: 178387
Formula: C13H14O4S
MW: 266.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight266.31
XLogP30.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass266.06128010
Monoisotopic Mass266.06128010
Topological Polar Surface Area76.7 Ų
Heavy Atom Count18
Formal Charge0
Complexity444
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

Alternative Products

CatalogName
T70843-01Orazipone

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