TL;DR: Vesnarinone (CAS 81840-15-5) is a chemical compound with molecular formula C22H25N3O4 and molecular weight 395.1845 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-3,4-dihydro-1H-quinolin-2-one
Also Known As: vesnarinone, Arkin-Z, Vesnarinona, Arkin, Piteranometozine
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H25N3O4 |
| Molecular Weight | 395.1845 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 71.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 395.1845 Da |
| Heavy Atoms | 29 |
| Complexity | 593.0 |
| SMILES | COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)CC4)OC |
| InChIKey | ZVNYJIZDIRKMBF-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vesnarinone. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Vesnarinone. Following Lipinski's Rule of Five, Vesnarinone has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Vesnarinone is 81840-15-5.
The molecular formula of Vesnarinone is C22H25N3O4.
The molecular weight of Vesnarinone is 395.1845 g/mol.
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