Products for Research Use Only

Ziprasidone Sulfone

CAT: 1459-CS-O-10046Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-10046Size:1 Each
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ziprasidone Sulfone is listed under Metabolite and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Ziprasidone. The product is supplied by Clearsynth under CAT No. CS-O-10046. 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 metabolite of Ziprasidone (Z485000) .
CAS Number
188797-77-5
Synonyms
Ziprasidone Sulfone
Molecular Formula
C 21 H 21 ClN 4 O 3 S
Molecular Weight
444.9
Additionnal Information
Ziprasidone Sulfone is supplied with detailed characterization data compliant with regulatory guideline. Ziprasidone Sulfone 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 Ziprasidone.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
A metabolite of Ziprasidone (Z485000) .
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Ziprasidone Sulfone
CAS Number188797-77-5
PubChem CID9889695
IUPAC Name6-chloro-5-[2-[4-(1,1-dioxo-1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]-1,3-dihydroindol-2-one
Molecular FormulaC21H21ClN4O3S
Molecular Weight444.9
XLogP1.9
Topological Polar Surface Area90.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity806
SMILES
C1CN(CCN1CCC2=C(C=C3C(=C2)CC(=O)N3)Cl)C4=NS(=O)(=O)C5=CC=CC=C54
InChI
InChI=1S/C21H21ClN4O3S/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)30(28,29)24-21/h1-4,11,13H,5-10,12H2,(H,23,27)
InChIKey
ZVNYBRYFGRKHFN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ziprasidone Sulfone
CAS: 188797-77-5
CID: 9889695
Formula: C21H21ClN4O3S
MW: 444.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight444.9
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass444.1022894
Monoisotopic Mass444.1022894
Topological Polar Surface Area90.5 Ų
Heavy Atom Count30
Formal Charge0
Complexity806
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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