TL;DR: 3-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one (CAS 6272-43-1) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07355 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3,4-dihydroxyphenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
Also Known As: 2',3,4-Trihydroxychalcone, 2',3,4-Trihydroxychalkon, 2',3,4-Trihydroxychalkon [German], 3-(3,4-dihydroxyphenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one, 2-Propen-1-one,3-(3,4-dihydroxyphenyl)-1-(2-hydroxyphenyl)-
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C15H12O4 |
| Molecular Weight | 256.07355 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.07355 Da |
| Heavy Atoms | 19 |
| Complexity | 339.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)C=CC2=CC(=C(C=C2)O)O)O |
| InChIKey | PSYVAIWGYVDYHN-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 3-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one. Following Lipinski's Rule of Five, 3-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one has 3 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-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one is 6272-43-1.
The molecular formula of 3-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one is C15H12O4.
The molecular weight of 3-(3,4-Dihydroxyphenyl)-1-(2-hydroxyphenyl)-2-propen-1-one is 256.07355 g/mol.
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