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Vilanterol

CAT: 0013-GTR19160311-02Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19160311-02Size:200 mg
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Description
Vilanterol is a selective long-acting beta2-adrenergic agonist (LABA) used in the treatment of COPD and asthma.
CAS Number
503068-34-6
Product Name Alternative
GW642444X | GW642444
Field of Research
Pharmacology & Drug Discovery
Purity
>98% (HPLC)
Solubility
DMSO : ≥ 100 mg/mL; 205.58 mM
Smiles
C1 (c (cc (cc1) [C@H] (CNCCCCCCOCCOCc1c (cccc1Cl) Cl) O) CO) O
Molecular Formula
C24H33Cl2NO5
Molecular Weight
486.43
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

Vilanterol

Vilanterol is an dichlorobenzene derivative that is used in the form of its trifenate salt for treatment of chronic obstructive pulmonary disease. It has a role as a beta-adrenergic agonist and a bronchodilator agent. It is a member of benzyl alcohols, a dichlorobenzene, an ether, a member of phenols and a secondary amino compound. It is a conjugate base of a vilanterol(1+).

CAS Number503068-34-6
PubChem CID10184665
IUPAC Name4-[(1R)-2-[6-[2-[(2,6-dichlorophenyl)methoxy]ethoxy]hexylamino]-1-hydroxyethyl]-2-(hydroxymethyl)phenol
Molecular FormulaC24H33Cl2NO5
Molecular Weight486.4
XLogP3.8
Topological Polar Surface Area91.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count16
Heavy Atom Count32
Formal Charge0
Complexity466
SMILES
C1=CC(=C(C(=C1)Cl)COCCOCCCCCCNC[C@@H](C2=CC(=C(C=C2)O)CO)O)Cl
InChI
InChI=1S/C24H33Cl2NO5/c25-21-6-5-7-22(26)20(21)17-32-13-12-31-11-4-2-1-3-10-27-15-24(30)18-8-9-23(29)19(14-18)16-28/h5-9,14,24,27-30H,1-4,10-13,15-17H2/t24-/m0/s1
InChIKey
DAFYYTQWSAWIGS-DEOSSOPVSA-N
Chemical Structure
2D Structure
2D structure of Vilanterol
CAS: 503068-34-6
CID: 10184665
Formula: C24H33Cl2NO5
MW: 486.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight486.4
XLogP33.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count16
Exact Mass485.1735785
Monoisotopic Mass485.1735785
Topological Polar Surface Area91.2 Ų
Heavy Atom Count32
Formal Charge0
Complexity466
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
C03396-1gVilanterol
RM-V091224-01Vilanterol Impurity 24 ((S) -Vilanterol)
B1006-25Vilanterol trifenatate
CS-O-44244Vilanterol Racemate
TRC-D432360-100MGVilanterol Dimer

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