TL;DR: (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one (CAS 1354942-41-8) is a chemical compound with molecular formula C18H18O3 and molecular weight 282.12558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(3,4-dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one
Also Known As: (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one, (E)-3-(3,4-Dimethoxyphenyl)-1-(o-tolyl)prop-2-en-1-one, (E)-3-(3,4-dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one
| Molecular Formula | C18H18O3 |
| Molecular Weight | 282.12558 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 282.12558 Da |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
| SMILES | CC1=CC=CC=C1C(=O)/C=C/C2=CC(=C(C=C2)OC)OC |
| InChIKey | JKMRTOZNTGQUBG-CSKARUKUSA-N |
The XLogP value of 4.0 indicates that (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)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 35.5 Ų, (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)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 (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one is 1354942-41-8.
The molecular formula of (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one is C18H18O3.
The molecular weight of (2E)-3-(3,4-Dimethoxyphenyl)-1-(2-methylphenyl)prop-2-en-1-one is 282.12558 g/mol.
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