TL;DR: 3-(4-Methoxybenzamido)propanoic acid (CAS 121428-49-7) is a chemical compound with molecular formula C11H13NO4 and molecular weight 223.08446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-methoxybenzoyl)amino]propanoic acid
Also Known As: 3-(4-Methoxybenzamido)propanoic acid, 3-[(4-methoxybenzoyl)amino]propanoic Acid, N-(4-Methoxybenzoyl)-beta-alanine, 3-[(4-methoxyphenyl)formamido]propanoic acid, 3-(4-Methoxybenzamido)propanoicacid
| Molecular Formula | C11H13NO4 |
| Molecular Weight | 223.08446 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.08446 Da |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
| SMILES | COC1=CC=C(C=C1)C(=O)NCCC(=O)O |
| InChIKey | WXKWDNRHJJLROS-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Methoxybenzamido)propanoic acid. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Methoxybenzamido)propanoic acid. Following Lipinski's Rule of Five, 3-(4-Methoxybenzamido)propanoic acid 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 3-(4-Methoxybenzamido)propanoic acid is 121428-49-7.
The molecular formula of 3-(4-Methoxybenzamido)propanoic acid is C11H13NO4.
The molecular weight of 3-(4-Methoxybenzamido)propanoic acid is 223.08446 g/mol.
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