TL;DR: (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one (CAS 132971-94-9) is a chemical compound with molecular formula C15H11BrO2 and molecular weight 301.99423 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one
Also Known As: 4 -Bromo-2-hydroxychalcone, J1.379.789G, AB01320602-02, 1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one, (2E)-1-(4-Bromophenyl)-3-(2-hydroxyphenyl)-2-propen-1-one
| Molecular Formula | C15H11BrO2 |
| Molecular Weight | 301.99423 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.99423 Da |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
| SMILES | C1=CC=C(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)Br)O |
| InChIKey | HEJGDFOMSHMVLZ-JXMROGBWSA-N |
The XLogP value of 4.0 indicates that (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)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 37.3 Ų, (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one is 132971-94-9.
The molecular formula of (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one is C15H11BrO2.
The molecular weight of (2E)-1-(4-bromophenyl)-3-(2-hydroxyphenyl)prop-2-en-1-one is 301.99423 g/mol.
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