TL;DR: 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one (CAS 1346457-87-1) is a chemical compound with molecular formula C17H15FO3 and molecular weight 286.10052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2,5-dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one
Also Known As: 3-(2,5-dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one, (2E)-3-(2,5-dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one, (E)-3-(2,5-dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one
| Molecular Formula | C17H15FO3 |
| Molecular Weight | 286.10052 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.10052 Da |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
| SMILES | COC1=CC(=C(C=C1)OC)C=CC(=O)C2=CC=C(C=C2)F |
| InChIKey | WNEXAQQSIRHLFE-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one has 0 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 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one is 1346457-87-1.
The molecular formula of 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one is C17H15FO3.
The molecular weight of 3-(2,5-Dimethoxyphenyl)-1-(4-fluorophenyl)prop-2-en-1-one is 286.10052 g/mol.
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