TL;DR: (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one (CAS 1367707-37-6) is a chemical compound with molecular formula C21H18O4 and molecular weight 334.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one
Also Known As: (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one, (2E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one, (E)-3-(2,3-DIMETHOXYPHENYL)-1-(1-HYDROXY-2-NAPHTHYL)-2-PROPEN-1-ONE
| Molecular Formula | C21H18O4 |
| Molecular Weight | 334.1205 g/mol |
| XLogP | 5.1 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.1205 Da |
| Heavy Atoms | 25 |
| Complexity | 475.0 |
| SMILES | COC1=CC=CC(=C1OC)/C=C/C(=O)C2=C(C3=CC=CC=C3C=C2)O |
| InChIKey | CQQDEJGEKATKBY-ACCUITESSA-N |
The XLogP value of 5.1 indicates that (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-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 55.8 Ų, (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one is 1367707-37-6.
The molecular formula of (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one is C21H18O4.
The molecular weight of (E)-3-(2,3-dimethoxyphenyl)-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one is 334.1205 g/mol.
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