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Roxadustat-d5

CAT: 1459-CS-O-35166Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-35166Size:1 Each
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Description
Roxadustat-d5 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Roxadustat. The product is supplied by Clearsynth under CAT No. CS-O-35166. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
2043026-13-5
Synonyms
Roxadustat-d5
Molecular Formula
C 19 H 11 D 5 N 2 O 5
Molecular Weight
357.37
Additionnal Information
Roxadustat-d5 is supplied with detailed characterization data compliant with regulatory guideline. Roxadustat-d5 can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Roxadustat.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Roxadustat-d5
CAS Number2043026-13-5
PubChem CID141649539
IUPAC Name2-[[4-hydroxy-1-methyl-7-(2,3,4,5,6-pentadeuteriophenoxy)isoquinoline-3-carbonyl]amino]acetic acid
Molecular FormulaC19H16N2O5
Molecular Weight357.4
XLogP3.4
Topological Polar Surface Area109
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity508
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])OC2=CC3=C(N=C(C(=C3C=C2)O)C(=O)NCC(=O)O)C)[2H])[2H]
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)/i2D,3D,4D,5D,6D
InChIKey
YOZBGTLTNGAVFU-VIQYUKPQSA-N
Chemical Structure
2D Structure
2D structure of Roxadustat-d5
CAS: 2043026-13-5
CID: 141649539
Formula: C19H16N2O5
MW: 357.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight357.4
XLogP33.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass357.13730534
Monoisotopic Mass357.13730534
Topological Polar Surface Area109 Ų
Heavy Atom Count26
Formal Charge0
Complexity508
Isotope Atom Count5
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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