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CAY10649

CAT: 0013-GTR19232850-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19232850-01Size:1 mg
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Description
1CAY10649 is a potent thiazolinone inhibitor of 5-lipoxygenase (5-LO), effectively blocking leukotriene biosynthesis in both intact PMNLs (IC50=0.28 μM) and cell lysates (IC50=0.09 μM) . This mechanism supports its research utility in studying inflammatory pathways, including neutrophil chemotaxis and vascular permeability, in cellular and biochemical assays.
CAS Number
1272519-89-7
Field of Research
Neuroscience
Smiles
C (=C/1\SC (=NC1=O) C2=CC=C (Cl) C=C2) \C3=CC=C (OC) C=C3
Molecular Formula
C17H12ClNO2S
Molecular Weight
329.8
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H-thiazol-4-one
CAS Number1272519-89-7
PubChem CID46898079
IUPAC Name(5Z)-2-(4-chlorophenyl)-5-[(4-methoxyphenyl)methylidene]-1,3-thiazol-4-one
Molecular FormulaC17H12ClNO2S
Molecular Weight329.8
XLogP4.7
Topological Polar Surface Area64
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity475
SMILES
COC1=CC=C(C=C1)/C=C\2/C(=O)N=C(S2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C17H12ClNO2S/c1-21-14-8-2-11(3-9-14)10-15-16(20)19-17(22-15)12-4-6-13(18)7-5-12/h2-10H,1H3/b15-10-
InChIKey
BYPSEBXZQCBFIP-GDNBJRDFSA-N
Chemical Structure
2D Structure
2D structure of (Z)-2-(4-Chlorophenyl)-5-(4-methoxybenzylidene)-5H-thiazol-4-one
CAS: 1272519-89-7
CID: 46898079
Formula: C17H12ClNO2S
MW: 329.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight329.8
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass329.0277275
Monoisotopic Mass329.0277275
Topological Polar Surface Area64 Ų
Heavy Atom Count22
Formal Charge0
Complexity475
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

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