TL;DR: (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one (CAS 1334721-78-6) is a chemical compound with molecular formula C14H11FO2 and molecular weight 230.07431 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one
Also Known As: Probes1_000114, Probes2_000115, CHEMBRDG-BB5136251, 3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one, AB00074285-01
| Molecular Formula | C14H11FO2 |
| Molecular Weight | 230.07431 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.07431 Da |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
| SMILES | CC1=CC=C(O1)C(=O)/C=C/C2=CC(=CC=C2)F |
| InChIKey | XFTFESMGIFGXLA-VOTSOKGWSA-N |
The XLogP value of 3.6 indicates that (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)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 30.2 Ų, (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one 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 (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one is 1334721-78-6.
The molecular formula of (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one is C14H11FO2.
The molecular weight of (E)-3-(3-fluorophenyl)-1-(5-methylfuran-2-yl)prop-2-en-1-one is 230.07431 g/mol.
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