TL;DR: 3-(5-Acetamido-2-methoxyphenoxy)propanoic acid (CAS 121062-95-1) is a chemical compound with molecular formula C12H15NO5 and molecular weight 253.09502 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(5-acetamido-2-methoxyphenoxy)propanoic acid
Also Known As: 3-(5-acetamido-2-methoxy-phenoxy)propanoic Acid, Propanoic acid, 3-[5-(acetylamino)-2-methoxyphenoxy]-
| Molecular Formula | C12H15NO5 |
| Molecular Weight | 253.09502 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.09502 Da |
| Heavy Atoms | 18 |
| Complexity | 294.0 |
| SMILES | CC(=O)NC1=CC(=C(C=C1)OC)OCCC(=O)O |
| InChIKey | NHHBKXJUMFFXJN-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Acetamido-2-methoxyphenoxy)propanoic acid. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Acetamido-2-methoxyphenoxy)propanoic acid. Following Lipinski's Rule of Five, 3-(5-Acetamido-2-methoxyphenoxy)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-(5-Acetamido-2-methoxyphenoxy)propanoic acid is 121062-95-1.
The molecular formula of 3-(5-Acetamido-2-methoxyphenoxy)propanoic acid is C12H15NO5.
The molecular weight of 3-(5-Acetamido-2-methoxyphenoxy)propanoic acid is 253.09502 g/mol.
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