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Acoramidis hydrochloride

CAT: 1568-C18509-100mgSize: 100 mgDry Ice: NoHazardous: No
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CAT#:1568-C18509-100mgSize:100 mg
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CAS Number
2242751-53-5
Synonyms
AG10 hydrochloride
Molecular Formula
C15H17FN2O3.ClH
Additionnal Information
Acoramidis hydrochloride (AG10 hydrochloride) is an orally active, selective kinetic stabilizer of WT-transthyretin (TTR) and V122I mutant transthyretin (TTR), providing effective treatment for transthyretin amyloid cardiomyopathy (ATTR-CM) .

Chemical Information

Acoramidis Hydrochloride

Acoramidis Hydrochloride is the hydrochloride salt form of acoramidis, a potent, highly selective, orally bioavailable transthyretin (TTR) stabilizer with potential disease-modifying activity. Upon oral administration, acoramidis binds to and stabilizes transthyretin (TTR), thereby preventing tetramer dissociation into monomers. This prevents misfolding of the TTR protein and inhibits the formation of TTR amyloid fibrils and the subsequent deposition of these insoluble protein clusters in the heart and peripheral nerves. TTR is a transport protein for thyroxine and retinol and is secreted by the liver into the blood. The accumulation of TTR amyloid fibrils may result in thickening and stiffening of the ventricular wall, leading to heart failure.

CAS Number2242751-53-5
PubChem CID135307127
IUPAC Name3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid;hydrochloride
Molecular FormulaC15H18ClFN2O3
Molecular Weight328.76
Topological Polar Surface Area75.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity356
SMILES
CC1=C(C(=NN1)C)CCCOC2=C(C=CC(=C2)C(=O)O)F.Cl
InChI
InChI=1S/C15H17FN2O3.ClH/c1-9-12(10(2)18-17-9)4-3-7-21-14-8-11(15(19)20)5-6-13(14)16;/h5-6,8H,3-4,7H2,1-2H3,(H,17,18)(H,19,20);1H
InChIKey
MGFZEARHINUOMX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acoramidis Hydrochloride
CAS: 2242751-53-5
CID: 135307127
Formula: C15H18ClFN2O3
MW: 328.76
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight328.76
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass328.0989983
Monoisotopic Mass328.0989983
Topological Polar Surface Area75.2 Ų
Heavy Atom Count22
Formal Charge0
Complexity356
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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