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INF 195

CAT: 0013-GTR19243474-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19243474-07Size:100 mg
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Description
INF 195 is an inflammasome NLRP3 inhibitor that inhibits NLRP3-driven macrophage pyroptosis and IL-1β release. INF 195 reduces isoproterenol-induced hypertrophy in H9c2 rat myoblasts and can be used to study myocardial ischemia and myocardial infarction.
CAS Number
1211379-56-4
Purity
>98% (HPLC)
Smiles
O=C (OCC) C1CN (C (=O) CCC=2C=CC=CC2Cl) CCC1
Molecular Formula
C17H22ClNO3
Molecular Weight
323.81
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Ethyl 1-(3-(2-chlorophenyl)propanoyl)piperidine-3-carboxylate
CAS Number1211379-56-4
PubChem CID45840201
IUPAC Nameethyl 1-[3-(2-chlorophenyl)propanoyl]piperidine-3-carboxylate
Molecular FormulaC17H22ClNO3
Molecular Weight323.8
XLogP3
Topological Polar Surface Area46.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity388
SMILES
CCOC(=O)C1CCCN(C1)C(=O)CCC2=CC=CC=C2Cl
InChI
InChI=1S/C17H22ClNO3/c1-2-22-17(21)14-7-5-11-19(12-14)16(20)10-9-13-6-3-4-8-15(13)18/h3-4,6,8,14H,2,5,7,9-12H2,1H3
InChIKey
GYNZAFIFTANTDS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ethyl 1-(3-(2-chlorophenyl)propanoyl)piperidine-3-carboxylate
CAS: 1211379-56-4
CID: 45840201
Formula: C17H22ClNO3
MW: 323.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight323.8
XLogP33
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass323.1288213
Monoisotopic Mass323.1288213
Topological Polar Surface Area46.6 Ų
Heavy Atom Count22
Formal Charge0
Complexity388
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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