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Cinepazide

CAT: 0931-T0368L-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T0368L-01Size:25 mg
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CAS Number
23887-46-9
Target
Others, Calcium Channel
Related Pathways
Others, Metabolism, Membrane transporter/Ion channel
Bioactivity
Cinepazide is a vasodilator used for the treatment of cardiovascular, cerebrovascular, and peripheral vascular diseases. Cinepazide acts as a potentiator of adenosine A2 receptors.
Smiles
COc1cc(\C=C\C(=O)N2CCN(CC(=O)N3CCCC3)CC2)cc(OC)c1OC
Molecular Formula
C22H31N3O5
Molecular Weight
417.5
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Cinepazide

Cinepazide is an olefinic compound. It is functionally related to a cinnamic acid.

CAS Number23887-46-9
PubChem CID5282459
IUPAC Name(E)-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Molecular FormulaC22H31N3O5
Molecular Weight417.5
XLogP1.5
Topological Polar Surface Area71.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count30
Formal Charge0
Complexity586
SMILES
COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCN(CC2)CC(=O)N3CCCC3
InChI
InChI=1S/C22H31N3O5/c1-28-18-14-17(15-19(29-2)22(18)30-3)6-7-20(26)25-12-10-23(11-13-25)16-21(27)24-8-4-5-9-24/h6-7,14-15H,4-5,8-13,16H2,1-3H3/b7-6+
InChIKey
RCUDFXMNPQNBDU-VOTSOKGWSA-N
Chemical Structure
2D Structure
2D structure of Cinepazide
CAS: 23887-46-9
CID: 5282459
Formula: C22H31N3O5
MW: 417.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight417.5
XLogP31.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass417.22637110
Monoisotopic Mass417.22637110
Topological Polar Surface Area71.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity586
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
B3293-100Cinepazide
HY-66010-01Cinepazide (Maleate)
MBS577549Cinepazide maleate
RM-C141501-01Cinepazide Impurity A

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