TL;DR: 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one (CAS 898464-81-8) is a chemical compound with molecular formula C23H29N3O4 and molecular weight 411.21582 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one
Also Known As: F2617-0127, 5-(2-oxo-2-(piperidin-1-yl)ethoxy)-2-((4-phenylpiperazin-1-yl)methyl)-4H-pyran-4-one, 5-(2-oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one, 5-[2-oxo-2-(piperidin-1-yl)ethoxy]-2-[(4-phenylpiperazin-1-yl)methyl]-4H-pyran-4-one, 5-[2-oxo-2-(1-piperidyl)ethoxy]-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one
| Molecular Formula | C23H29N3O4 |
| Molecular Weight | 411.21582 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 62.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.21582 Da |
| Heavy Atoms | 30 |
| Complexity | 670.0 |
| SMILES | C1CCN(CC1)C(=O)COC2=COC(=CC2=O)CN3CCN(CC3)C4=CC=CC=C4 |
| InChIKey | ICFCLLQOJXEXRG-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one. Following Lipinski's Rule of Five, 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one is 898464-81-8.
The molecular formula of 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one is C23H29N3O4.
The molecular weight of 5-(2-Oxo-2-piperidin-1-ylethoxy)-2-[(4-phenylpiperazin-1-yl)methyl]pyran-4-one is 411.21582 g/mol.
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