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Albendazole-d3 Sulfoxide

CAT: 1459-CS-O-02843Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-02843Size:1 Each
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Description
Albendazole-d3 Sulfoxide is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Albendazole. The product is supplied by Clearsynth under CAT No. CS-O-02843. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
"Labeled metabolite of Albendazole, intended for use as an internal standard for the quantification of Albendazole by GC- or LC-mass spectrometry."
CAS Number
1448346-38-0
Synonyms
Albendazole-d3 Sulfoxide
Molecular Formula
C 12 H 12 D 3 N 3 O 3 S
Molecular Weight
284.35
Additionnal Information
Albendazole-d3 Sulfoxide is supplied with detailed characterization data compliant with regulatory guideline. Albendazole-d3 Sulfoxide 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 Albendazole.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
"Labeled metabolite of Albendazole, intended for use as an internal standard for the quantification of Albendazole by GC- or LC-mass spectrometry."
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

Albendazole sulfoxide-D3
CAS Number1448346-38-0
PubChem CID91886198
IUPAC Nametrideuteriomethyl N-(6-propylsulfinyl-1H-benzimidazol-2-yl)carbamate
Molecular FormulaC12H15N3O3S
Molecular Weight284.35
XLogP1.4
Topological Polar Surface Area103
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity353
SMILES
[2H]C([2H])([2H])OC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)CCC
InChI
InChI=1S/C12H15N3O3S/c1-3-6-19(17)8-4-5-9-10(7-8)14-11(13-9)15-12(16)18-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)/i2D3
InChIKey
VXTGHWHFYNYFFV-BMSJAHLVSA-N
Chemical Structure
2D Structure
2D structure of Albendazole sulfoxide-D3
CAS: 1448346-38-0
CID: 91886198
Formula: C12H15N3O3S
MW: 284.35
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight284.35
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass284.10224276
Monoisotopic Mass284.10224276
Topological Polar Surface Area103 Ų
Heavy Atom Count19
Formal Charge0
Complexity353
Isotope Atom Count3
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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