TL;DR: 1,7-Dihydroxy-3,8-dimethoxyxanthone (CAS 15402-27-4) is a chemical compound with molecular formula C15H12O6 and molecular weight 288.0634 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,8-dihydroxy-1,6-dimethoxyxanthen-9-one
Also Known As: Gentiacaulein, Getiacaulein, Gentianacaulein, 2,6-dimethoxyxanthone, 2,8-dihydroxy-1,6-dimethoxyxanthone
| Molecular Formula | C15H12O6 |
| Molecular Weight | 288.0634 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 85.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.0634 Da |
| Heavy Atoms | 21 |
| Complexity | 400.0 |
| SMILES | COC1=CC(=C2C(=C1)OC3=C(C2=O)C(=C(C=C3)O)OC)O |
| InChIKey | WYOSCUWDVFHQFY-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,7-Dihydroxy-3,8-dimethoxyxanthone. The TPSA of 85.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,7-Dihydroxy-3,8-dimethoxyxanthone. Following Lipinski's Rule of Five, 1,7-Dihydroxy-3,8-dimethoxyxanthone has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,7-Dihydroxy-3,8-dimethoxyxanthone is 15402-27-4.
The molecular formula of 1,7-Dihydroxy-3,8-dimethoxyxanthone is C15H12O6.
The molecular weight of 1,7-Dihydroxy-3,8-dimethoxyxanthone is 288.0634 g/mol.
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