TL;DR: 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane (CAS 825607-25-8) is a chemical compound with molecular formula C17H24FN3O and molecular weight 305.19034 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azepan-1-yl-[4-(2-fluorophenyl)piperazin-1-yl]methanone
Also Known As: 1-[4-(2-fluorophenyl)piperazine-1-carbonyl]azepane, F3083-0235, AP-124/43237955, azepan-1-yl(4-(2-fluorophenyl)piperazin-1-yl)methanone, azepan-1-yl-[4-(2-fluorophenyl)piperazin-1-yl]methanone
| Molecular Formula | C17H24FN3O |
| Molecular Weight | 305.19034 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 305.19034 Da |
| Heavy Atoms | 22 |
| Complexity | 363.0 |
| SMILES | C1CCCN(CC1)C(=O)N2CCN(CC2)C3=CC=CC=C3F |
| InChIKey | FCJZTQDHXSZJQV-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane. With a topological polar surface area (TPSA) of 26.8 Ų, 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane 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 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane is 825607-25-8.
The molecular formula of 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane is C17H24FN3O.
The molecular weight of 1-[4-(2-Fluorophenyl)piperazine-1-carbonyl]azepane is 305.19034 g/mol.
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