Cinepazide MaleateProduct ingredient for Cinepazide

Name
Cinepazide Maleate
Drug Entry
Cinepazide

Cinepazide has been used in trials studying the treatment of Ischemic Stroke.

Accession Number
DBSALT002138
Structure
Synonyms
Not Available
UNII
Y35B3VA60V
CAS Number
26328-04-1
Weight
Average: 533.578
Monoisotopic: 533.237329719
Chemical Formula
C26H35N3O9
InChI Key
XSTJTOKYCAJVMJ-GVTSEVKNSA-N
InChI
InChI=1S/C22H31N3O5.C4H4O4/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;5-3(6)1-2-4(7)8/h6-7,14-15H,4-5,8-13,16H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b7-6+;2-1-
IUPAC Name
(2E)-1-{4-[2-oxo-2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one; (2Z)-but-2-enedioic acid
SMILES
OC(=O)\C=C/C(O)=O.COC1=CC(\C=C\C(=O)N2CCN(CC(=O)N3CCCC3)CC2)=CC(OC)=C1OC
ChemSpider
4445610
Predicted Properties
PropertyValueSource
Water Solubility0.502 mg/mLALOGPS
logP1.67ALOGPS
logP0.67Chemaxon
logS-2.9ALOGPS
pKa (Strongest Basic)5.91Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area71.55 Å2Chemaxon
Rotatable Bond Count9Chemaxon
Refractivity115.36 m3·mol-1Chemaxon
Polarizability46.38 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon