Products for Research Use Only

Emlenoflast

CAT: 0013-GTR19165697-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165697-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Emlenoflast (MCC7840) is a potent and selective small molecule inhibitor targeting the NLRP3 inflammasome. It is a valuable research tool for investigating NLRP3-driven pathologies, such as inflammatory and autoimmune diseases, in both cellular assays and animal models.
CAS Number
1995067-59-8
Product Name Alternative
Inhibit, inflammatory, inflammasome, NLR, NLRP3, NOD-like Receptor, NODlikeReceptor, NODlikeReceptor (NLR), NODlike Receptor (NLR), NOD-like Receptor (NLR), Inhibitor, MCC7840, MCC-7840, MCC 7840, Emlenoflast, sulfonylurea
Field of Research
Immunology & Inflammation, Signal Transduction
Purity
97.00% (May vary between batches)
Smiles
N (C (NS (=O) (=O) C1=NN (C (C) C) C=C1) =O) C2=C3C (=CC4=C2CCC4) CCC3
Molecular Formula
C19H24N4O3S
Molecular Weight
388.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Emlenoflast
CAS Number1995067-59-8
PubChem CID122480653
IUPAC Name1-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)-3-(1-propan-2-ylpyrazol-3-yl)sulfonylurea
Molecular FormulaC19H24N4O3S
Molecular Weight388.5
XLogP3.6
Topological Polar Surface Area101
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity642
SMILES
CC(C)N1C=CC(=N1)S(=O)(=O)NC(=O)NC2=C3CCCC3=CC4=C2CCC4
InChI
InChI=1S/C19H24N4O3S/c1-12(2)23-10-9-17(21-23)27(25,26)22-19(24)20-18-15-7-3-5-13(15)11-14-6-4-8-16(14)18/h9-12H,3-8H2,1-2H3,(H2,20,22,24)
InChIKey
MTOUOUSKXWSTAX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Emlenoflast
CAS: 1995067-59-8
CID: 122480653
Formula: C19H24N4O3S
MW: 388.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight388.5
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass388.15691181
Monoisotopic Mass388.15691181
Topological Polar Surface Area101 Ų
Heavy Atom Count27
Formal Charge0
Complexity642
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