TL;DR: (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one (CAS 1627738-14-0) is a chemical compound with molecular formula C13H9BrO3 and molecular weight 291.9735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one
Also Known As: (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one, 1-(5-bromo-2-hydroxyphenyl)-3-(2-furyl)-2-propen-1-one, AN-646/41051369, (2E)-1-(5-bromo-2-hydroxyphenyl)-3-(2-furyl)prop-2-en-1-one, (E)-1-(5-bromo-2-hydroxy-phenyl)-3-(2-furyl)prop-2-en-1-one
| Molecular Formula | C13H9BrO3 |
| Molecular Weight | 291.9735 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.9735 Da |
| Heavy Atoms | 17 |
| Complexity | 303.0 |
| SMILES | C1=COC(=C1)/C=C/C(=O)C2=C(C=CC(=C2)Br)O |
| InChIKey | FHDMEGWONAAPEK-GQCTYLIASA-N |
The XLogP value of 3.7 indicates that (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-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 50.4 Ų, (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one has 1 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)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one is 1627738-14-0.
The molecular formula of (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one is C13H9BrO3.
The molecular weight of (E)-1-(5-bromo-2-hydroxyphenyl)-3-(furan-2-yl)prop-2-en-1-one is 291.9735 g/mol.
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