TL;DR: Phenyl 4-(2-pyridyl)piperazinyl ketone (CAS 166438-06-8) is a chemical compound with molecular formula C16H17N3O and molecular weight 267.13718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl-(4-pyridin-2-ylpiperazin-1-yl)methanone
Also Known As: 1-benzoyl-4-(pyridin-2-yl)piperazine, PHENYL 4-(2-PYRIDYL)PIPERAZINYL KETONE, Phenyl-(4-pyridin-2-ylpiperazin-1-yl)methanone, 1-Benzoyl-4-(2-pyridinyl)piperazine, Phenyl(4-(pyridin-2-yl)piperazin-1-yl)methanone
| Molecular Formula | C16H17N3O |
| Molecular Weight | 267.13718 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 267.13718 Da |
| Heavy Atoms | 20 |
| Complexity | 320.0 |
| SMILES | C1CN(CCN1C2=CC=CC=N2)C(=O)C3=CC=CC=C3 |
| InChIKey | DODMPXGYBRIUJQ-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl 4-(2-pyridyl)piperazinyl ketone. With a topological polar surface area (TPSA) of 36.4 Ų, Phenyl 4-(2-pyridyl)piperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 4-(2-pyridyl)piperazinyl ketone 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 Phenyl 4-(2-pyridyl)piperazinyl ketone is 166438-06-8.
The molecular formula of Phenyl 4-(2-pyridyl)piperazinyl ketone is C16H17N3O.
The molecular weight of Phenyl 4-(2-pyridyl)piperazinyl ketone is 267.13718 g/mol.
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