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Sarolaner

CAT: 1459-CS-ZH-34087Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-ZH-34087Size:1 Each
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Description
Sarolaner is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Sarolaner. The product is supplied by Clearsynth under CAT No. CS-ZH-34087. 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
1398609-39-6
Synonyms
Sarolaner
Molecular Formula
C 23 H 18 Cl 2 F 4 N 2 O 5 S
Molecular Weight
581.36
Additionnal Information
Sarolaner is supplied with detailed characterization data compliant with regulatory guideline. Sarolaner 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 Sarolaner.
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

Sarolaner

Sarolaner is a small molecule drug. Sarolaner has a monoisotopic molecular weight of 580.02 Da.

CAS Number1398609-39-6
PubChem CID73169092
IUPAC Name1-[6-[(5S)-5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]spiro[1H-2-benzofuran-3,3'-azetidine]-1'-yl]-2-methylsulfonylethanone
Molecular FormulaC23H18Cl2F4N2O5S
Molecular Weight581.4
XLogP3.4
Topological Polar Surface Area93.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Heavy Atom Count37
Formal Charge0
Complexity1050
SMILES
CS(=O)(=O)CC(=O)N1CC2(C1)C3=C(CO2)C=C(C=C3)C4=NO[C@@](C4)(C5=CC(=C(C(=C5)Cl)F)Cl)C(F)(F)F
InChI
InChI=1S/C23H18Cl2F4N2O5S/c1-37(33,34)9-19(32)31-10-21(11-31)15-3-2-12(4-13(15)8-35-21)18-7-22(36-30-18,23(27,28)29)14-5-16(24)20(26)17(25)6-14/h2-6H,7-11H2,1H3/t22-/m0/s1
InChIKey
FLEFKKUZMDEUIP-QFIPXVFZSA-N
Chemical Structure
2D Structure
2D structure of Sarolaner
CAS: 1398609-39-6
CID: 73169092
Formula: C23H18Cl2F4N2O5S
MW: 581.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight581.4
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count10
Rotatable Bond Count4
Exact Mass580.0249609
Monoisotopic Mass580.0249609
Topological Polar Surface Area93.7 Ų
Heavy Atom Count37
Formal Charge0
Complexity1050
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-16730-01Sarolaner
A21115-5Sarolaner 5mg
A21115-100Sarolaner 100mg
A21115-50Sarolaner 50mg
A21115-10Sarolaner 10mg
AR-S09961-01Rac-Sarolaner
A21115-25Sarolaner 25mg
A21115-1Sarolaner 1mg
AR-S09960-01Sarolaner Impurity 1
A21115-10mM-DSarolaner 10mM * 1mL in DMSO

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