TL;DR: 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid (CAS 1030900-19-6) is a chemical compound with molecular formula C15H14FNO4 and molecular weight 291.0907 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-fluorophenyl)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid
Also Known As: 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid, 4-(4-fluorophenyl)-2-(furan-2-ylmethylamino)-4-oxobutanoic acid, 4-(4-fluorophenyl)-2-[(2-furylmethyl)amino]-4-oxobutanoic acid, 4-(4-fluorophenyl)-2-{[(furan-2-yl)methyl]amino}-4-oxobutanoic acid, 4-(4-fluorophenyl)-2-(2-furylmethylamino)-4-oxo-butanoic Acid
| Molecular Formula | C15H14FNO4 |
| Molecular Weight | 291.0907 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 79.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.0907 Da |
| Heavy Atoms | 21 |
| Complexity | 369.0 |
| SMILES | C1=COC(=C1)CNC(CC(=O)C2=CC=C(C=C2)F)C(=O)O |
| InChIKey | RYTQAPMMBRADGN-UHFFFAOYSA-N |
The XLogP value of -0.8 indicates that 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid 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 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid is 1030900-19-6.
The molecular formula of 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid is C15H14FNO4.
The molecular weight of 4-(4-Fluorophenyl)-2-((2-furylmethyl)amino)-4-oxobutanoic acid is 291.0907 g/mol.
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