TL;DR: 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic acid (CAS 167887-37-8) is a chemical compound with molecular formula C17H19NO4 and molecular weight 301.1314 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-3-(3-methoxy-4-phenylmethoxyphenyl)propanoic acid
Also Known As: RARECHEM AL BL 0062, 3-amino-3-(3-methoxy-4-phenylmethoxyphenyl)propanoic acid, 3-AMINO-3-(4-BENZYLOXY-3-METHOXY-PHENYL)-PROPIONIC ACID, 3-AMINO-3-[4-(BENZYLOXY)-3-METHOXYPHENYL]PROPANOIC ACID, 3-Amino-3-(4-benzyloxy-3-methoxy-phenyl)-propionic
| Molecular Formula | C17H19NO4 |
| Molecular Weight | 301.1314 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 301.1314 Da |
| Heavy Atoms | 22 |
| Complexity | 344.0 |
| SMILES | COC1=C(C=CC(=C1)C(CC(=O)O)N)OCC2=CC=CC=C2 |
| InChIKey | ZTBVHMNMNSGPKJ-UHFFFAOYSA-N |
The XLogP value of -0.8 indicates that 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic acid. Following Lipinski's Rule of Five, 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic 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 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic acid is 167887-37-8.
The molecular formula of 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic acid is C17H19NO4.
The molecular weight of 3-Amino-3-[4-(benzyloxy)-3-methoxyphenyl]propanoic acid is 301.1314 g/mol.
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