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Baxdrostat

CAT: 0804-HY-132809-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-132809-06Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Baxdrostat is a aldosterone synthase inhibitor[1].
CAS Number
1428652-17-8
Product Name Alternative
CIN-107
UNSPSC
12352005
Target
Mineralocorticoid Receptor
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease; Vitamin D Related/Nuclear Receptor
Applications
Metabolism-sugar/lipid metabolism
Field of Research
Endocrinology
Assay Protocol
https://www.medchemexpress.com/baxdrostat.html
Purity
99.32
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
CCC(N[C@H]1C2=CN=CC(C3=CC=C(N(C(CC4)=O)C)C4=C3)=C2CCC1)=O
Molecular Formula
C22H25N3O2
Molecular Weight
363.45
References & Citations
[1] International Nonproprietary Names for Pharmaceutical Substances (INN)
Shipping Conditions
Blue Ice
Storage Conditions
-20°C, 3 years (Powder)
Scientific Category
Reference compound1
Clinical Information
Phase 3

Chemical Information

Baxdrostat

Baxdrostat is under investigation in clinical trial NCT06344104 (A Phase III Study to Investigate the Efficacy and Safety of Baxdrostat in Asian Participants With Uncontrolled Hypertension on Two or More Medications Including Participants With Resistant Hypertension).

CAS Number1428652-17-8
PubChem CID71535962
IUPAC NameN-[(8R)-4-(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)-5,6,7,8-tetrahydroisoquinolin-8-yl]propanamide
Molecular FormulaC22H25N3O2
Molecular Weight363.5
XLogP2.2
Topological Polar Surface Area62.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity566
SMILES
CCC(=O)N[C@@H]1CCCC2=C1C=NC=C2C3=CC4=C(C=C3)N(C(=O)CC4)C
InChI
InChI=1S/C22H25N3O2/c1-3-21(26)24-19-6-4-5-16-17(12-23-13-18(16)19)14-7-9-20-15(11-14)8-10-22(27)25(20)2/h7,9,11-13,19H,3-6,8,10H2,1-2H3,(H,24,26)/t19-/m1/s1
InChIKey
VDEUDSRUMNAXJG-LJQANCHMSA-N
Chemical Structure
2D Structure
2D structure of Baxdrostat
CAS: 1428652-17-8
CID: 71535962
Formula: C22H25N3O2
MW: 363.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight363.5
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass363.19467705
Monoisotopic Mass363.19467705
Topological Polar Surface Area62.3 Ų
Heavy Atom Count27
Formal Charge0
Complexity566
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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