Products for Research Use Only

Cinepazet

CAT: 0013-GTR19235801-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19235801-02Size:5 mg
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Description
Cinepazet is a vasodilator compound utilized in cardiovascular research. It is employed in both in vitro and in vivo experimental models to investigate mechanisms of vascular function and related disease pathologies.
CAS Number
23887-41-4
Product Name Alternative
Cinepazet
Field of Research
Pharmacology & Drug Discovery
Purity
99.05% (May vary between batches)
Smiles
O=C (OCC) CN1CCN (C (=O) C=CC2=CC (OC) =C (OC) C (OC) =C2) CC1
Molecular Formula
C20H28N2O6
Molecular Weight
392.45
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Cinepazet

Cinepazet is an alpha-amino acid ester.

CAS Number23887-41-4
PubChem CID6434395
IUPAC Nameethyl 2-[4-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]acetate
Molecular FormulaC20H28N2O6
Molecular Weight392.4
XLogP1.8
Topological Polar Surface Area77.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity519
SMILES
CCOC(=O)CN1CCN(CC1)C(=O)/C=C/C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C20H28N2O6/c1-5-28-19(24)14-21-8-10-22(11-9-21)18(23)7-6-15-12-16(25-2)20(27-4)17(13-15)26-3/h6-7,12-13H,5,8-11,14H2,1-4H3/b7-6+
InChIKey
XDUOTWNXVDBCDY-VOTSOKGWSA-N
Chemical Structure
2D Structure
2D structure of Cinepazet
CAS: 23887-41-4
CID: 6434395
Formula: C20H28N2O6
MW: 392.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight392.4
XLogP31.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass392.19473662
Monoisotopic Mass392.19473662
Topological Polar Surface Area77.5 Ų
Heavy Atom Count28
Formal Charge0
Complexity519
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

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