TL;DR: 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl- (CAS 109251-79-8) is a chemical compound with molecular formula C17H21N3O and molecular weight 283.16846 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-2-(1-methylpiperidin-4-yl)-6-phenylpyridazin-3-one
Also Known As: 4-24-00-00555 (Beilstein Handbook Reference), 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl-, (N-Methylpiperidino)-2 methyl-4 phenyl-6 pyridazone-3, (N-Methylpiperidino)-2 methyl-4 phenyl-6 pyridazone-3 [French], 4-methyl-2-(1-methylpiperidin-4-yl)-6-phenylpyridazin-3-one
| Molecular Formula | C17H21N3O |
| Molecular Weight | 283.16846 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 35.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 283.16846 Da |
| Heavy Atoms | 21 |
| Complexity | 455.0 |
| SMILES | CC1=CC(=NN(C1=O)C2CCN(CC2)C)C3=CC=CC=C3 |
| InChIKey | KCKKRVFJCMEJRR-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl-. With a topological polar surface area (TPSA) of 35.9 Ų, 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl- is 109251-79-8.
The molecular formula of 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl- is C17H21N3O.
The molecular weight of 3(2H)-Pyridazinone, 4-methyl-2-(1-methyl-4-piperidyl)-6-phenyl- is 283.16846 g/mol.
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