TL;DR: 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid (CAS 107497-22-3) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-[3-(2-amino-2-carboxyethyl)phenyl]propanoic acid
Also Known As: 3-(2-amino-2-carboxyethyl)phenylalanine, 2-amino-3-[3-(2-amino-2-carboxy-ethyl)phenyl]propanoic Acid, 2-Amino-3-[3-(2-amino-2-carboxyethyl)phenyl]propionic acid, 2-amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid, 2-amino-3-[3-(2-amino-3-hydroxy-3-oxopropyl)phenyl]propanoic acid
| Molecular Formula | C12H16N2O4 |
| Molecular Weight | 252.11101 g/mol |
| XLogP | -4.9 |
| Topological Polar Surface Area (TPSA) | 127.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 252.11101 Da |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
| SMILES | C1=CC(=CC(=C1)CC(C(=O)O)N)CC(C(=O)O)N |
| InChIKey | DZCMRCRDZVWADN-UHFFFAOYSA-N |
The XLogP value of -4.9 indicates that 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid. Following Lipinski's Rule of Five, 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid has 4 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 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid is 107497-22-3.
The molecular formula of 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid is C12H16N2O4.
The molecular weight of 2-Amino-3-[3-(2-amino-2-carboxy-ethyl)-phenyl]-propionic acid is 252.11101 g/mol.
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