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Satigrel

CAT: 0931-T24760-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T24760-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
111753-73-2
Target
Prostaglandin Receptor, Others
Related Pathways
GPCR/G Protein, Immunology/Inflammation, Others
Bioactivity
Satigrel is a new antiplatelet agent. It also inhibits platelet accumulation in prosthetic arterial grafts.
Smiles
C(=C(CCC(O)=O)C#N)(C1=CC=C(OC)C=C1)C2=CC=C(OC)C=C2
Molecular Formula
C20H19NO4
Molecular Weight
337.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Satigrel

Satigrel is a small molecule drug. Satigrel has a monoisotopic molecular weight of 337.13 Da.

CAS Number111753-73-2
PubChem CID65913
IUPAC Name4-cyano-5,5-bis(4-methoxyphenyl)pent-4-enoic acid
Molecular FormulaC20H19NO4
Molecular Weight337.4
XLogP3.7
Topological Polar Surface Area79.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count25
Formal Charge0
Complexity491
SMILES
COC1=CC=C(C=C1)C(=C(CCC(=O)O)C#N)C2=CC=C(C=C2)OC
InChI
InChI=1S/C20H19NO4/c1-24-17-8-3-14(4-9-17)20(16(13-21)7-12-19(22)23)15-5-10-18(25-2)11-6-15/h3-6,8-11H,7,12H2,1-2H3,(H,22,23)
InChIKey
GRVCTHTXJDYIHB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Satigrel
CAS: 111753-73-2
CID: 65913
Formula: C20H19NO4
MW: 337.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight337.4
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass337.13140809
Monoisotopic Mass337.13140809
Topological Polar Surface Area79.6 Ų
Heavy Atom Count25
Formal Charge0
Complexity491
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

Alternative Products

CatalogName
BA5728-25Satigrel

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