TL;DR: 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl- (CAS 118024-33-2) is a chemical compound with molecular formula C19H16O4 and molecular weight 308.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E)-1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenylpenta-2,4-dien-1-one
Also Known As: 1-(5-Acetyl-2,4-dihydroxyphenyl)-5-phenyl-2,4-pentadien-1-one, 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl-, (2E,4E)-1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenylpenta-2,4-dien-1-one, BRN 5346336
| Molecular Formula | C19H16O4 |
| Molecular Weight | 308.10486 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.10486 Da |
| Heavy Atoms | 23 |
| Complexity | 474.0 |
| SMILES | CC(=O)C1=CC(=C(C=C1O)O)C(=O)/C=C/C=C/C2=CC=CC=C2 |
| InChIKey | XQGJGIHVARYARV-NXZHAISVSA-N |
The XLogP value of 4.4 indicates that 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl-. Following Lipinski's Rule of Five, 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl- 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 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl- is 118024-33-2.
The molecular formula of 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl- is C19H16O4.
The molecular weight of 2,4-Pentadien-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-5-phenyl- is 308.10486 g/mol.
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