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Anagrelide (hydrochloride)

CAT: 0804-HY-B0523A-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B0523A-01Size:5 mg
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Description
Anagrelide hydrochloride (BL4162A) is a potent inhibitor of phosphodiesterase type III (PDE3) (IC50=36 nM) . Anagrelide hydrochloride, an imidazoquinazoline derivative, acts as an inhibitor of platelet aggregation. Anagrelide hydrochloride inhibits bone marrow megakaryocytopoiesis. Anagrelide hydrochloride decreases gastrointestinal stromal tumor (GIST) cell proliferation and promotes their apoptosis in vitro. Anagrelide hydrochloride is a platelet-lowering agent and plays in the antithrombopoietic action[1][2][3].
CAS Number
58579-51-4
Product Name Alternative
BL4162A
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Apoptosis; Phosphodiesterase (PDE)
Type
Reference compound
Related Pathways
Apoptosis; Metabolic Enzyme/Protease
Applications
COVID-19-immunoregulation
Field of Research
Cancer; Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/Anagrelide-hydrochloride.html
Purity
99.39
Solubility
DMSO : 6.36 mg/mL (ultrasonic; warming; heat to 60°C) |H2O : < 0.1 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
ClC1=C(CN(C2)C3=NC2=O)C(N3)=CC=C1Cl.Cl
Molecular Formula
C10H8Cl3N3O
Molecular Weight
292.55
Precautions
H302, H315, H319, H335
References & Citations
[1]Pescatore, S.L. and C. Lindley, Anagrelide: a novel agent for the treatment of myeloproliferative disorders. Expert Opin Pharmacother, 2000. 1 (3) : p. 537-46.|[2]Petrides, P.E., Anagrelide: what was new in 2004 and 2005? Semin Thromb Hemost, 2006. 32 (4 Pt 2) : p. 399-408.
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, sealed storage, away from moisture)
Scientific Category
Reference compound1
Clinical Information
Launched

Chemical Information

Anagrelide Hydrochloride

Anagrelide hydrochloride is the hydrochloride salt of anagrelide. It has a role as an antifibrinolytic drug and a platelet aggregation inhibitor. It contains an anagrelide.

CAS Number58579-51-4
PubChem CID135413494
IUPAC Name6,7-dichloro-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one;hydrochloride
Molecular FormulaC10H8Cl3N3O
Molecular Weight292.5
Topological Polar Surface Area44.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count17
Formal Charge0
Complexity360
SMILES
C1C2=C(C=CC(=C2Cl)Cl)N=C3N1CC(=O)N3.Cl
InChI
InChI=1S/C10H7Cl2N3O.ClH/c11-6-1-2-7-5(9(6)12)3-15-4-8(16)14-10(15)13-7;/h1-2H,3-4H2,(H,13,14,16);1H
InChIKey
TVWRQCIPWUCNMI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Anagrelide Hydrochloride
CAS: 58579-51-4
CID: 135413494
Formula: C10H8Cl3N3O
MW: 292.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass290.973295
Monoisotopic Mass290.973295
Topological Polar Surface Area44.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity360
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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