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Roxadustat

CAT: 1410-M16021-05Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M16021-05Size:100 mg
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Description
Roxadustat (FG4592, FG-4592) is a potent, orally available HIF prolyl hydroxylase (HIF-PHD) with IC50 of 591.4 nM.
CAS Number
808118-40-3
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
352.3407
Molecular Formula
C19H16N2O5
Notes
Research use only, not for human use.
Receptor
HIF-PH

Chemical Information

FG 4592

Roxadustat is an N-acylglycine resulting from the formal condensation of the amino group of glycine with the carboxy group of 4-hydroxy-1-methyl-7-phenoxyisoquinoline-3-carboxylic acid. It is an inhibitor of hypoxia inducible factor prolyl hydroxylase (HIF-PH). It has a role as an EC 1.14.11.29 (hypoxia-inducible factor-proline dioxygenase) inhibitor and an EC 1.14.11.2 (procollagen-proline dioxygenase) inhibitor. It is a N-acylglycine, a member of isoquinolines and an aromatic ether.

CAS Number808118-40-3
PubChem CID11256664
IUPAC Name2-[(4-hydroxy-1-methyl-7-phenoxyisoquinoline-3-carbonyl)amino]acetic acid
Molecular FormulaC19H16N2O5
Molecular Weight352.3
XLogP3.4
Topological Polar Surface Area109
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity508
SMILES
CC1=C2C=C(C=CC2=C(C(=N1)C(=O)NCC(=O)O)O)OC3=CC=CC=C3
InChI
InChI=1S/C19H16N2O5/c1-11-15-9-13(26-12-5-3-2-4-6-12)7-8-14(15)18(24)17(21-11)19(25)20-10-16(22)23/h2-9,24H,10H2,1H3,(H,20,25)(H,22,23)
InChIKey
YOZBGTLTNGAVFU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of FG 4592
CAS: 808118-40-3
CID: 11256664
Formula: C19H16N2O5
MW: 352.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.3
XLogP33.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass352.10592162
Monoisotopic Mass352.10592162
Topological Polar Surface Area109 Ų
Heavy Atom Count26
Formal Charge0
Complexity508
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

Alternative Products

CatalogName
MBS3606019-01Roxadustat
CS-O-35166Roxadustat-d5
HY-13426R-01Roxadustat (Standard)
TRC-G140140-750MGGlycyl Roxadustat
CS-O-47474Roxadustat 13C215N
CS-O-41009Roxadustat d2
AR-R11589-01Roxadustat Aziridine
MBS384709-01FG-4592 (Roxadustat)
RM-R152425-01Roxadustat Impurity 25
RM-R152462-01Roxadustat Impurity 62

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