TL;DR: 3-Hydroxylapachone (CAS 15297-98-0) is a chemical compound with molecular formula C15H14O4 and molecular weight 258.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-hydroxy-2,2-dimethyl-3,4-dihydrobenzo[h]chromene-5,6-dione
Also Known As: 3-Hydroxy-beta-lapachone, 3-Hydroxylapachone, Sentocarpoquinone A, 3-Hydroxy I(2)-lapachone, beta-Lapachone, 3-hydroxy-
| Molecular Formula | C15H14O4 |
| Molecular Weight | 258.0892 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 258.0892 Da |
| Heavy Atoms | 19 |
| Complexity | 475.0 |
| SMILES | CC1(C(CC2=C(O1)C3=CC=CC=C3C(=O)C2=O)O)C |
| InChIKey | MFHPSBRWDZUZHF-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxylapachone. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hydroxylapachone. Following Lipinski's Rule of Five, 3-Hydroxylapachone 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 3-Hydroxylapachone is 15297-98-0.
The molecular formula of 3-Hydroxylapachone is C15H14O4.
The molecular weight of 3-Hydroxylapachone is 258.0892 g/mol.
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