TL;DR: Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- (CAS 1243-34-1) is a chemical compound with molecular formula C20H25FN2O2 and molecular weight 344.19 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-fluorophenyl)piperazine
Also Known As: Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)-, 5-23-02-00160 (Beilstein Handbook Reference), 1-(3,4-Dimethoxyphenethyl)-4-(o-fluorophenyl)piperazine, 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(2-fluorophenyl)piperazine, 1-(3,4-Dimethoxyphenethyl)-4-(2-fluorophenyl)piperazine
| Molecular Formula | C20H25FN2O2 |
| Molecular Weight | 344.19 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 24.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 344.19 Da |
| Heavy Atoms | 25 |
| Complexity | 390.0 |
| SMILES | COC1=C(C=C(C=C1)CCN2CCN(CC2)C3=CC=CC=C3F)OC |
| InChIKey | GPXKMNIDKFNKIO-UHFFFAOYSA-N |
The XLogP value of 3.9 indicates that Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.9 Ų, Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- is 1243-34-1.
The molecular formula of Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- is C20H25FN2O2.
The molecular weight of Piperazine, 1-(3,4-dimethoxyphenethyl)-4-(o-fluorophenyl)- is 344.19 g/mol.
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