TL;DR: 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one (CAS 152969-68-1) is a chemical compound with molecular formula C15H9ClO4 and molecular weight 288.01895 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chlorophenyl)-5,7-dihydroxychromen-4-one
Also Known As: 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one, 5,7-Dihydroxy-3 -chloroflavone, J1.351.758D, 2-(3-chlorophenyl)-5,7-dihydroxychromen-4-one, 2-(3-chlorophenyl)-5,7-dihydroxy-chromen-4-one
| Molecular Formula | C15H9ClO4 |
| Molecular Weight | 288.01895 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 288.01895 Da |
| Heavy Atoms | 20 |
| Complexity | 422.0 |
| SMILES | C1=CC(=CC(=C1)Cl)C2=CC(=O)C3=C(C=C(C=C3O2)O)O |
| InChIKey | NNZXUWPQCQOANK-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one. Following Lipinski's Rule of Five, 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one has 2 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 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one is 152969-68-1.
The molecular formula of 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one is C15H9ClO4.
The molecular weight of 2-(3-Chlorophenyl)-5,7-dihydroxy-4H-chromen-4-one is 288.01895 g/mol.
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