TL;DR: Cabreuvin (CAS 1621-61-0) is a chemical compound with molecular formula C18H16O5 and molecular weight 312.09976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-dimethoxyphenyl)-7-methoxychromen-4-one
Also Known As: Cabreuvin, 7,3',4'-Trimethoxyisoflavone, 3',4',7-Trimethoxyisoflavone, TimTec1_006616, 3',4',7-Trihydroxyisoflavone
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C18H16O5 |
| Molecular Weight | 312.09976 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.09976 Da |
| Heavy Atoms | 23 |
| Complexity | 460.0 |
| SMILES | COC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC(=C(C=C3)OC)OC |
| InChIKey | UKWLNMIPRJLYGH-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that Cabreuvin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Cabreuvin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cabreuvin has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Cabreuvin is 1621-61-0.
The molecular formula of Cabreuvin is C18H16O5.
The molecular weight of Cabreuvin is 312.09976 g/mol.
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