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Desloratadine N-Oxide

CAT: 1459-CS-T-52177Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-52177Size:1 Each
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Description
Desloratadine N-Oxide is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Desloratadine. The product is supplied by Clearsynth under CAT No. CS-T-52177. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
A degradation product of Desloratadine. Desloratadine impurity.
CAS Number
169253-26-3
Synonyms
Desloratadine N-Oxide
Molecular Formula
C 19 H 19 ClN 2 O
Molecular Weight
326.8
Additionnal Information
Desloratadine N-Oxide is supplied with detailed characterization data compliant with regulatory guideline. Desloratadine N-Oxide 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 Desloratadine.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
A degradation product of Desloratadine. Desloratadine impurity.
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

Desloratadine Pyridine N-oxide
CAS Number169253-26-3
PubChem CID18715187
IUPAC Name13-chloro-4-oxido-2-piperidin-4-ylidene-4-azoniatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaene
Molecular FormulaC19H19ClN2O
Molecular Weight326.8
XLogP2.2
Topological Polar Surface Area37.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count23
Formal Charge0
Complexity458
SMILES
C1CC2=C(C=CC(=C2)Cl)C(=C3CCNCC3)C4=C1C=CC=[N+]4[O-]
InChI
InChI=1S/C19H19ClN2O/c20-16-5-6-17-15(12-16)4-3-14-2-1-11-22(23)19(14)18(17)13-7-9-21-10-8-13/h1-2,5-6,11-12,21H,3-4,7-10H2
InChIKey
ZTRQZDOHUHWANO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Desloratadine Pyridine N-oxide
CAS: 169253-26-3
CID: 18715187
Formula: C19H19ClN2O
MW: 326.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight326.8
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass326.1185909
Monoisotopic Mass326.1185909
Topological Polar Surface Area37.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity458
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

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