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Diflapolin

CAT: 0013-GTR19165821-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165821-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Diflapolin is a potent and selective dual inhibitor of FLAP and soluble epoxide hydrolase (sEH), demonstrating significant anti-inflammatory activity. It is a valuable research tool for investigating eicosanoid pathways in models of inflammation, pain, and cardiovascular disease, with efficacy shown in both in vitro and in vivo studies.
CAS Number
724453-98-9
Product Name Alternative
Diflapolin, diseases, cysteinyl-LTs, 5-LO activating protein, neutrophil, Inhibitor, inhibit, infiltration, inflammation, FLAP, Epoxide Hydrolase, EpoxideHydrolase, sHE, permeability, vascular
Field of Research
Immunology & Inflammation, Metabolism Research
Purity
95.05% (May vary between batches)
Solubility
DMSO:84 mg/mL (183.26 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (7.2 mM)
Smiles
Cc1cc (OCc2nc3ccccc3s2) ccc1NC (=O) Nc1ccc (Cl) c (Cl) c1
Molecular Formula
C22H17Cl2N3O2S
Molecular Weight
458.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Diflapolin
CAS Number724453-98-9
PubChem CID4560409
IUPAC Name1-[4-(1,3-benzothiazol-2-ylmethoxy)-2-methylphenyl]-3-(3,4-dichlorophenyl)urea
Molecular FormulaC22H17Cl2N3O2S
Molecular Weight458.4
XLogP6.1
Topological Polar Surface Area91.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity587
SMILES
CC1=C(C=CC(=C1)OCC2=NC3=CC=CC=C3S2)NC(=O)NC4=CC(=C(C=C4)Cl)Cl
InChI
InChI=1S/C22H17Cl2N3O2S/c1-13-10-15(29-12-21-26-19-4-2-3-5-20(19)30-21)7-9-18(13)27-22(28)25-14-6-8-16(23)17(24)11-14/h2-11H,12H2,1H3,(H2,25,27,28)
InChIKey
FGXLEECGXSDIMM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diflapolin
CAS: 724453-98-9
CID: 4560409
Formula: C22H17Cl2N3O2S
MW: 458.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight458.4
XLogP36.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass457.0418534
Monoisotopic Mass457.0418534
Topological Polar Surface Area91.5 Ų
Heavy Atom Count30
Formal Charge0
Complexity587
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
MBS5765002Diflapolin

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