TL;DR: cinepazide maleate (CAS 1184963-62-9) is a chemical compound with molecular formula C26H35N3O9 and molecular weight 533.2373 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-but-2-enedioic acid;(E)-1-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-1-yl]-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
Also Known As: cinepazide maleate, I06-0425, 1-[(1-Pyrrolidinylcarbonyl)methyl]-4-(3,4,5-trimethoxycinnamoyl)piperazine maleate, 2-Propen-1-one, 1-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]-3-(3,4,5-trimethoxyphenyl)-, (2Z)-2-butenedioate (1:1), (2Z)-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
| Molecular Formula | C26H35N3O9 |
| Molecular Weight | 533.2373 g/mol |
| XLogP | 1.204 |
| Topological Polar Surface Area (TPSA) | 146.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 533.2373 Da |
| Heavy Atoms | 38 |
| Complexity | 705.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C/C(=O)N2CCN(CC2)CC(=O)N3CCCC3.C(=C/C(=O)O)\C(=O)O |
| InChIKey | XSTJTOKYCAJVMJ-XWHJEWPLSA-N |
The XLogP value of 1.204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cinepazide maleate. The TPSA of 146.0 Ų indicates high polarity, suggesting cinepazide maleate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, cinepazide maleate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of cinepazide maleate is 1184963-62-9.
The molecular formula of cinepazide maleate is C26H35N3O9.
The molecular weight of cinepazide maleate is 533.2373 g/mol.
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