TL;DR: (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one (CAS 139311-84-5) is a chemical compound with molecular formula C15H9FO3 and molecular weight 256.05356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2Z)-2-[(4-fluorophenyl)methylidene]-6-hydroxy-1-benzofuran-3-one
Also Known As: (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one, (Z)-2-(4-fluorobenzylidene)-6-hydroxybenzofuran-3(2H)-one, (2Z)-2-[(4-fluorophenyl)methylidene]-6-hydroxy-1-benzofuran-3-one, VU0492680-1, (2Z)-2-[(4-fluorophenyl)methylidene]-6-hydroxy-2,3-dihydro-1-benzofuran-3-one
| Molecular Formula | C15H9FO3 |
| Molecular Weight | 256.05356 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 256.05356 Da |
| Heavy Atoms | 19 |
| Complexity | 385.0 |
| SMILES | C1=CC(=CC=C1/C=C\2/C(=O)C3=C(O2)C=C(C=C3)O)F |
| InChIKey | LRUJRAQGJJEHMX-AUWJEWJLSA-N |
The XLogP value of 3.3 indicates that (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one has 1 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 (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one is 139311-84-5.
The molecular formula of (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one is C15H9FO3.
The molecular weight of (2Z)-2-(4-fluorobenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one is 256.05356 g/mol.
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