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Selnoflast

CAT: 1568-C01919-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1568-C01919-02Size:25 mg
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CAS Number
2260969-36-4
Synonyms
RO-7486967
SKU
C01919-5mg
Target
NLRP3
Applications
Immunology & Inflammation
Additionnal Information
Selnoflast (RO-7486967) is a selective and reversible small molecule inhibitor of NLRP3 inflammasome, with the potential to treat moderate to severe active ulcerative colitis.

Chemical Information

Selnoflast

Selnoflast is a small molecule drug. The usage of the INN stem '-noflast' in the name indicates that Selnoflast is a inflammasome protein NLRP3 inhibitor. Selnoflast is under investigation in clinical trial NCT05924243 (A Study to Investigate The Safety, Tolerability, Pharmacokinetics and Pharmacodynamics of RO7486967 in Participants With Early Idiopathic Parkinson's Disease.). Selnoflast has a monoisotopic molecular weight of 391.19 Da.

CAS Number2260969-36-4
PubChem CID137402358
IUPAC Name1-(1-ethylpiperidin-4-yl)sulfonyl-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea
Molecular FormulaC20H29N3O3S
Molecular Weight391.5
XLogP3.7
Topological Polar Surface Area86.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity619
SMILES
CCN1CCC(CC1)S(=O)(=O)NC(=O)NC2=C3CCCC3=CC4=C2CCC4
InChI
InChI=1S/C20H29N3O3S/c1-2-23-11-9-16(10-12-23)27(25,26)22-20(24)21-19-17-7-3-5-14(17)13-15-6-4-8-18(15)19/h13,16H,2-12H2,1H3,(H2,21,22,24)
InChIKey
OHIFQOUPTWBQLE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Selnoflast
CAS: 2260969-36-4
CID: 137402358
Formula: C20H29N3O3S
MW: 391.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight391.5
XLogP33.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass391.19296297
Monoisotopic Mass391.19296297
Topological Polar Surface Area86.9 Ų
Heavy Atom Count27
Formal Charge0
Complexity619
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
E1872-25mgSelnoflast
T78614-01Selnoflast potassium
MBS5820276Selnoflast calcium
HY-132831ASelnoflast (calcium)
HY-132831BSelnoflast (potassium)
HY-132831CSelnoflast (monopotassium)
GTR19274528-01Selnoflast monopotassium

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