TL;DR: Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)- (CAS 158631-47-1) is a chemical compound with molecular formula C15H19N3O2 and molecular weight 273.14774 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-oxo-2-piperidin-1-ylethyl)-1,3-dihydrocinnolin-4-one
Also Known As: Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)-, 1-((3,4-Dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)piperidine, 2-(2-oxo-2-piperidin-1-ylethyl)-1,3-dihydrocinnolin-4-one, 2-[2-Oxo-2-(piperidin-1-yl)ethyl]-2,3-dihydrocinnolin-4(1H)-one
| Molecular Formula | C15H19N3O2 |
| Molecular Weight | 273.14774 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.14774 Da |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
| SMILES | C1CCN(CC1)C(=O)CN2CC(=O)C3=CC=CC=C3N2 |
| InChIKey | HEQJYFISZHBUSW-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)-. With a topological polar surface area (TPSA) of 52.7 Ų, Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)- is 158631-47-1.
The molecular formula of Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)- is C15H19N3O2.
The molecular weight of Piperidine, 1-((3,4-dihydro-4-oxo-2(1H)-cinnolinyl)acetyl)- is 273.14774 g/mol.
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