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Itopride-d6 Hydrochloride

CAT: 1459-CS-O-14820Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-14820Size:1 Each
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Description
Itopride-d6 Hydrochloride is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Itopride. The product is supplied by Clearsynth under CAT No. CS-O-14820. 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
1346601-02-2
Synonyms
Itopride-d6 Hydrochloride
Molecular Formula
C 20 H 21 D 6 ClN 2 O 4
Molecular Weight
400.93
Additionnal Information
Itopride-d6 Hydrochloride is supplied with detailed characterization data compliant with regulatory guideline. Itopride-d6 Hydrochloride 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 Itopride.
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

Itopride-d6 Hydrochloride
CAS Number1346601-02-2
PubChem CID71749645
IUPAC NameN-[[4-[2-[bis(trideuteriomethyl)amino]ethoxy]phenyl]methyl]-3,4-dimethoxybenzamide;hydrochloride
Molecular FormulaC20H27ClN2O4
Molecular Weight400.9
Topological Polar Surface Area60
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count27
Formal Charge0
Complexity411
SMILES
[2H]C([2H])([2H])N(CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)OC)OC)C([2H])([2H])[2H].Cl
InChI
InChI=1S/C20H26N2O4.ClH/c1-22(2)11-12-26-17-8-5-15(6-9-17)14-21-20(23)16-7-10-18(24-3)19(13-16)25-4;/h5-10,13H,11-12,14H2,1-4H3,(H,21,23);1H/i1D3,2D3;
InChIKey
ZTOUXLLIPWWHSR-TXHXQZCNSA-N
Chemical Structure
2D Structure
2D structure of Itopride-d6 Hydrochloride
CAS: 1346601-02-2
CID: 71749645
Formula: C20H27ClN2O4
MW: 400.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight400.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass400.2035955
Monoisotopic Mass400.2035955
Topological Polar Surface Area60 Ų
Heavy Atom Count27
Formal Charge0
Complexity411
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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