TL;DR: (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one (CAS 1447848-18-1) is a chemical compound with molecular formula C22H18O3 and molecular weight 330.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-(4-hydroxyphenyl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one
Also Known As: (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one, 2-Propen-1-one, 1-(4-hydroxyphenyl)-3-[4-(phenylmethoxy)phenyl]-, (2E)-, (2E)-1-(4-Hydroxyphenyl)-3-[4-(phenylmethoxy)phenyl]-2-propen-1-one, (E)-1-(4-hydroxyphenyl)-3-(4-phenylmethoxyphenyl)prop-2-en-1-one, (E)-3-(4-(benzyloxy)phenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
| Molecular Formula | C22H18O3 |
| Molecular Weight | 330.12558 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.12558 Da |
| Heavy Atoms | 25 |
| Complexity | 423.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)/C=C/C(=O)C3=CC=C(C=C3)O |
| InChIKey | FNHVYURUALTEKK-OVCLIPMQSA-N |
The XLogP value of 4.8 indicates that (2E)-3-[4-(benzyloxy)phenyl]-1-(4-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 46.5 Ų, (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)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 (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one is 1447848-18-1.
The molecular formula of (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one is C22H18O3.
The molecular weight of (2E)-3-[4-(benzyloxy)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one is 330.12558 g/mol.
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