TL;DR: 'OMe-aldehyde' (TH 3) (CAS 142503-17-1) is a chemical compound with molecular formula C19H16O4 and molecular weight 308.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxy-4,6-dimethoxyphenyl)naphthalene-2-carbaldehyde
Also Known As: OMe-aldehyde (TH 3), 'OMe-aldehyde' (TH 3), 1-(2-hydroxy-4,6-dimethoxyphenyl)naphthalene-2-carbaldehyde
| Molecular Formula | C19H16O4 |
| Molecular Weight | 308.10486 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.10486 Da |
| Heavy Atoms | 23 |
| Complexity | 399.0 |
| SMILES | COC1=CC(=C(C(=C1)OC)C2=C(C=CC3=CC=CC=C32)C=O)O |
| InChIKey | BFXXQLDFQRKMAJ-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 'OMe-aldehyde' (TH 3) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, 'OMe-aldehyde' (TH 3) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 'OMe-aldehyde' (TH 3) has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 'OMe-aldehyde' (TH 3) is 142503-17-1.
The molecular formula of 'OMe-aldehyde' (TH 3) is C19H16O4.
The molecular weight of 'OMe-aldehyde' (TH 3) is 308.10486 g/mol.
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