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Ranolazine Bis (N-Oxide)

CAT: 1459-CS-O-10315Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-10315Size:1 Each
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Description
Ranolazine Bis (N-Oxide) is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Ranolazine. The product is supplied by Clearsynth under CAT No. CS-O-10315. 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 possible metabolite of Ranolazine .
CAS Number
1246816-00-1
Synonyms
Ranolazine Bis (N-Oxide)
Molecular Formula
C 24 H 33 N 3 O 6
Molecular Weight
459.54
Additionnal Information
Ranolazine Bis (N-Oxide) is supplied with detailed characterization data compliant with regulatory guideline. Ranolazine Bis (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 Ranolazine.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
A possible metabolite of Ranolazine .
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Ranolazine Bis(N-Oxide)
CAS Number1246816-00-1
PubChem CID71751975
IUPAC NameN-(2,6-dimethylphenyl)-2-[4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]-1,4-dioxidopiperazine-1,4-diium-1-yl]acetamide
Molecular FormulaC24H33N3O6
Molecular Weight459.5
XLogP2.2
Topological Polar Surface Area104
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count33
Formal Charge0
Complexity617
SMILES
CC1=C(C(=CC=C1)C)NC(=O)C[N+]2(CC[N+](CC2)(CC(COC3=CC=CC=C3OC)O)[O-])[O-]
InChI
InChI=1S/C24H33N3O6/c1-18-7-6-8-19(2)24(18)25-23(29)16-27(31)13-11-26(30,12-14-27)15-20(28)17-33-22-10-5-4-9-21(22)32-3/h4-10,20,28H,11-17H2,1-3H3,(H,25,29)
InChIKey
BIUBGFGNJNWYSV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ranolazine Bis(N-Oxide)
CAS: 1246816-00-1
CID: 71751975
Formula: C24H33N3O6
MW: 459.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight459.5
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass459.23693578
Monoisotopic Mass459.23693578
Topological Polar Surface Area104 Ų
Heavy Atom Count33
Formal Charge0
Complexity617
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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