TL;DR: 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid (CAS 121715-56-8) is a chemical compound with molecular formula C13H15NO4 and molecular weight 249.10011 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-amino-3-(5-methoxy-1-benzofuran-2-yl)butanoic acid
Also Known As: 4-Mbfg, 4-amino-3-(5-methoxy-1-benzofuran-2-yl)butanoic acid, 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid, BETA-5-METHOXYBENZOFURAN-2-YL-GABA, 2-Benzofuranpropanoicacid, b-(aminomethyl)-5-methoxy-
| Molecular Formula | C13H15NO4 |
| Molecular Weight | 249.10011 g/mol |
| XLogP | -1.3 |
| Topological Polar Surface Area (TPSA) | 85.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.10011 Da |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
| SMILES | COC1=CC2=C(C=C1)OC(=C2)C(CC(=O)O)CN |
| InChIKey | GAGNHCLRQLUYCQ-UHFFFAOYSA-N |
The XLogP value of -1.3 indicates that 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid. Following Lipinski's Rule of Five, 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid is 121715-56-8.
The molecular formula of 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid is C13H15NO4.
The molecular weight of 4-Amino-3-(5-methoxybenzo(b)furan-2-yl)butanoic acid is 249.10011 g/mol.
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