Products for Research Use Only

Acitazanolast

CAT: 0013-GTR19167374-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19167374-02Size:25 mg
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Description
Acitazanolast (WP-871) is a small molecule candidate for anti-allergic therapy. It functions as a thromboxane A2 receptor antagonist and has demonstrated inhibitory effects in both in vitro assays and in vivo models of allergic asthma and inflammation.
CAS Number
114607-46-4
Product Name Alternative
MTCC, Acitazanolast, WP871, WP-871, WP 871
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Purity
98.00% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (8.58 mM) ; DMSO:15 mg/mL (64.33 mM)
Smiles
OC (=O) C (=O) Nc1cccc (c1) -c1nnn[nH]1
Molecular Formula
C9H7N5O3
Molecular Weight
233.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Acitazanolast

Acitazanolast is a member of tetrazoles.

CAS Number114607-46-4
PubChem CID2006
IUPAC Name2-oxo-2-[3-(2H-tetrazol-5-yl)anilino]acetic acid
Molecular FormulaC9H7N5O3
Molecular Weight233.18
XLogP0.3
Topological Polar Surface Area121
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity311
SMILES
C1=CC(=CC(=C1)NC(=O)C(=O)O)C2=NNN=N2
InChI
InChI=1S/C9H7N5O3/c15-8(9(16)17)10-6-3-1-2-5(4-6)7-11-13-14-12-7/h1-4H,(H,10,15)(H,16,17)(H,11,12,13,14)
InChIKey
VWQZJJZGISNFOE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Acitazanolast
CAS: 114607-46-4
CID: 2006
Formula: C9H7N5O3
MW: 233.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight233.18
XLogP30.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass233.05488910
Monoisotopic Mass233.05488910
Topological Polar Surface Area121 Ų
Heavy Atom Count17
Formal Charge0
Complexity311
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