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AZD2389

CAT: 0957-E5969-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0957-E5969-03Size:100 mg
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Description
AZD2389 is a potent, orally active, and selective inhibitor of fibroblast activation protein (FAP) with the potential to treat metabolic dysfunction-associated steatohepatitis.
CAS Number
2791472-12-1
Target
Immunology & Inflammation related
Activity
Immunology & Inflammation
Molecular Formula
C20H21N5O3S

Chemical Information

N-[2-[(4R)-4-cyanothiazolidin-3-yl]-2-oxo-ethyl]-6-morpholino-quinoline-4-carboxamide

AZD2389 is an investigational small molecule inhibitor of fibroblast activation protein (FAP). It is currently undergoing safety, tolerability, and PK/PD profiling in clinical trials (e.g. NCT06973005: A Study to Investigate How Multiple Oral Doses of AZD2389 Affect the Pharmacokinetics of Midazolam, Caffeine, and Bupropion in Healthy Participants).

CAS Number2791472-12-1
PubChem CID164532637
IUPAC NameN-[2-[(4R)-4-cyano-1,3-thiazolidin-3-yl]-2-oxoethyl]-6-morpholin-4-ylquinoline-4-carboxamide
Molecular FormulaC20H21N5O3S
Molecular Weight411.5
XLogP1.1
Topological Polar Surface Area124
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity662
SMILES
C1COCCN1C2=CC3=C(C=CN=C3C=C2)C(=O)NCC(=O)N4CSC[C@H]4C#N
InChI
InChI=1S/C20H21N5O3S/c21-10-15-12-29-13-25(15)19(26)11-23-20(27)16-3-4-22-18-2-1-14(9-17(16)18)24-5-7-28-8-6-24/h1-4,9,15H,5-8,11-13H2,(H,23,27)/t15-/m1/s1
InChIKey
GECJKRWOVGXGCO-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of N-[2-[(4R)-4-cyanothiazolidin-3-yl]-2-oxo-ethyl]-6-morpholino-quinoline-4-carboxamide
CAS: 2791472-12-1
CID: 164532637
Formula: C20H21N5O3S
MW: 411.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight411.5
XLogP31.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass411.13651072
Monoisotopic Mass411.13651072
Topological Polar Surface Area124 Ų
Heavy Atom Count29
Formal Charge0
Complexity662
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
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