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Deschloro Vemurafenib

CAT: 1459-CS-O-10696Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-O-10696Size:1 Each
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Description
Deschloro Vemurafenib is listed under Impurity and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Vemurafenib. The product is supplied by Clearsynth under CAT No. CS-O-10696. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Impurity in commercial preparations of Vemurafenib.
CAS Number
918504-63-9
Synonyms
Deschloro Vemurafenib
Molecular Formula
C 23 H 19 F 2 N 3 O 3 S
Molecular Weight
455.48
Additionnal Information
Deschloro Vemurafenib is supplied with detailed characterization data compliant with regulatory guideline. Deschloro Vemurafenib 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 Vemurafenib.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Impurity in commercial preparations of Vemurafenib.
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

Vemurafenib impurity 5
CAS Number918504-63-9
PubChem CID58087865
IUPAC NameN-[2,4-difluoro-3-(5-phenyl-1H-pyrrolo[2,3-b]pyridine-3-carbonyl)phenyl]propane-1-sulfonamide
Molecular FormulaC23H19F2N3O3S
Molecular Weight455.5
XLogP4.3
Topological Polar Surface Area100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity756
SMILES
CCCS(=O)(=O)NC1=C(C(=C(C=C1)F)C(=O)C2=CNC3=C2C=C(C=N3)C4=CC=CC=C4)F
InChI
InChI=1S/C23H19F2N3O3S/c1-2-10-32(30,31)28-19-9-8-18(24)20(21(19)25)22(29)17-13-27-23-16(17)11-15(12-26-23)14-6-4-3-5-7-14/h3-9,11-13,28H,2,10H2,1H3,(H,26,27)
InChIKey
ZBYVHRGXNKMPDO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vemurafenib impurity 5
CAS: 918504-63-9
CID: 58087865
Formula: C23H19F2N3O3S
MW: 455.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight455.5
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass455.11151897
Monoisotopic Mass455.11151897
Topological Polar Surface Area100 Ų
Heavy Atom Count32
Formal Charge0
Complexity756
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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HY-12057S-01Vemurafenib-d5
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MBS386052-01PLX4032 (Vemurafenib)

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