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Resatorvid

CAT: 0013-GTR19166239-05Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19166239-05Size:10 mg
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Description
Resatorvid (TAK-242) is a selective TLR4 inhibitor that covalently binds to Cys747, disrupting TIRAP recruitment and downstream signaling. This small molecule is widely used in research for its demonstrated anti-inflammatory, neuroprotective, and antitumor effects in both cellular and animal models of sepsis, neuroinflammation, and cancer.
CAS Number
243984-11-4
Product Name Alternative
TLR, TLR4, TNF Receptor, TNF-R, TNFR, TAK242, TAK-242, TAK 242, Resatorvid, Toll-like Receptor (TLR), Tumor Necrosis Factor Receptor, TRIF, Interleukin Related, Interleukin, Inhibitor, inhibit, MyD88, inflammatory, IL-6, Autophagy, CLI-095, CLI095, CLI 095, diseases
Field of Research
Cell Biology, Immunology & Inflammation
Purity
99.31% (May vary between batches)
Solubility
H2O:Insoluble;10% DMSO+40% PEG300+5% Tween 80+45% Saline:5 mg/mL (13.82 mM) ; DMSO:255 mg/mL (704.77 mM)
Smiles
CCOC (=O) C1=CCCC[C@H]1S (=O) (=O) Nc1ccc (F) cc1Cl
Molecular Formula
C15H17ClFNO4S
Molecular Weight
361.82
Storage Conditions
Keep away from direct sunlight, store at low temperature | Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

Resatorvid

Resatorvid is an investigational compound designed for the treatment of severe sepsis.

CAS Number243984-11-4
PubChem CID11703255
IUPAC Nameethyl (6R)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]cyclohexene-1-carboxylate
Molecular FormulaC15H17ClFNO4S
Molecular Weight361.8
XLogP3
Topological Polar Surface Area80.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Heavy Atom Count23
Formal Charge0
Complexity560
SMILES
CCOC(=O)C1=CCCC[C@H]1S(=O)(=O)NC2=C(C=C(C=C2)F)Cl
InChI
InChI=1S/C15H17ClFNO4S/c1-2-22-15(19)11-5-3-4-6-14(11)23(20,21)18-13-8-7-10(17)9-12(13)16/h5,7-9,14,18H,2-4,6H2,1H3/t14-/m1/s1
InChIKey
LEEIJTHMHDMWLJ-CQSZACIVSA-N
Chemical Structure
2D Structure
2D structure of Resatorvid
CAS: 243984-11-4
CID: 11703255
Formula: C15H17ClFNO4S
MW: 361.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight361.8
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count6
Exact Mass361.0550851
Monoisotopic Mass361.0550851
Topological Polar Surface Area80.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity560
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS3612777-01Resatorvid
A11543-5Resatorvid 5mg
A11543-25Resatorvid 25mg
A11543-2Resatorvid 2mg
A11543-1Resatorvid 1mg
A11543-100Resatorvid 100mg
A11543-50Resatorvid 50mg
A11543-10Resatorvid 10mg
S7455-5mgResatorvid (TAK-242)
MBS130179-01TAK-242(Resatorvid)

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