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Varenicline Impurity 18

CAT: 1459-CS-EO-01913Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-EO-01913Size:1 Each
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Varenicline Impurity 18 is listed under Impurity and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Varenicline. The product is supplied by Clearsynth under CAT No. CS-EO-01913. 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
2306217-15-0
Synonyms
Varenicline Impurity 18
Molecular Formula
C 17 H 17 N 3 O 5
Molecular Weight
343.33
Additionnal Information
Varenicline Impurity 18 is supplied with detailed characterization data compliant with regulatory guideline. Varenicline Impurity 18 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 Varenicline.
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

2,3-Dihydroxy-4-oxo-4-(6,7,9,10-tetrahydro-8H-6,10-methanoazepino[4,5-g]quinoxalin-8-yl)butanoic acid
CAS Number2306217-15-0
PubChem CID154703630
IUPAC Name2,3-dihydroxy-4-oxo-4-(5,8,14-triazatetracyclo[10.3.1.02,11.04,9]hexadeca-2,4,6,8,10-pentaen-14-yl)butanoic acid
Molecular FormulaC17H17N3O5
Molecular Weight343.33
XLogP-1
Topological Polar Surface Area124
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity530
SMILES
C1C2CN(CC1C3=CC4=NC=CN=C4C=C23)C(=O)C(C(C(=O)O)O)O
InChI
InChI=1S/C17H17N3O5/c21-14(15(22)17(24)25)16(23)20-6-8-3-9(7-20)11-5-13-12(4-10(8)11)18-1-2-19-13/h1-2,4-5,8-9,14-15,21-22H,3,6-7H2,(H,24,25)
InChIKey
ANLPQXPHGCEMKB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,3-Dihydroxy-4-oxo-4-(6,7,9,10-tetrahydro-8H-6,10-methanoazepino[4,5-g]quinoxalin-8-yl)butanoic acid
CAS: 2306217-15-0
CID: 154703630
Formula: C17H17N3O5
MW: 343.33
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight343.33
XLogP3-1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count3
Exact Mass343.11682065
Monoisotopic Mass343.11682065
Topological Polar Surface Area124 Ų
Heavy Atom Count25
Formal Charge0
Complexity530
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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