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CP 424174

CAT: 0013-GTR19156935-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156935-02Size:500 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
CP 424174 is an inhibitor of IL-1β post-translational processing with IC50 of 210 nM. Inhibits the formation of mature IL-1β. Indirectly inhibits NLRP3. Active in vivo and orally bioavailable.
CAS Number
210825-31-3
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 125 mg/mL (275.94 mM)
Smiles
O=S (C1=CC=CC (C (C) (O) C) =C1) (NC (NC2=C (C (C) C) C=C (Cl) C=C2C (C) C) =O) =O
Molecular Formula
C22H29ClN2O4S
Molecular Weight
452.99
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

N-((4-Chloro-2,6-diisopropylphenyl)carbamoyl)-3-(2-hydroxypropan-2-yl)benzenesulfonamide
CAS Number210825-31-3
PubChem CID9911728
IUPAC Name1-[4-chloro-2,6-di(propan-2-yl)phenyl]-3-[3-(2-hydroxypropan-2-yl)phenyl]sulfonylurea
Molecular FormulaC22H29ClN2O4S
Molecular Weight453.0
XLogP5.2
Topological Polar Surface Area104
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count30
Formal Charge0
Complexity672
SMILES
CC(C)C1=CC(=CC(=C1NC(=O)NS(=O)(=O)C2=CC=CC(=C2)C(C)(C)O)C(C)C)Cl
InChI
InChI=1S/C22H29ClN2O4S/c1-13(2)18-11-16(23)12-19(14(3)4)20(18)24-21(26)25-30(28,29)17-9-7-8-15(10-17)22(5,6)27/h7-14,27H,1-6H3,(H2,24,25,26)
InChIKey
YRSBLSHMKVQWHP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-((4-Chloro-2,6-diisopropylphenyl)carbamoyl)-3-(2-hydroxypropan-2-yl)benzenesulfonamide
CAS: 210825-31-3
CID: 9911728
Formula: C22H29ClN2O4S
MW: 453.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight453.0
XLogP35.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass452.1536563
Monoisotopic Mass452.1536563
Topological Polar Surface Area104 Ų
Heavy Atom Count30
Formal Charge0
Complexity672
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

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