TL;DR: Ethyl oxo[(1-phenylethyl)amino]acetate (CAS 1398512-13-4) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-oxo-2-(1-phenylethylamino)acetate
Also Known As: ethyl oxo[(1-phenylethyl)amino]acetate, ethyl 2-oxo-2-(1-phenylethylamino)acetate, ethyloxo[(1-phenylethyl)amino]acetate, ethyl 2-oxo-2-((1-phenylethyl)amino)acetate, ETHYL [(1-PHENYLETHYL)CARBAMOYL]FORMATE
| Molecular Formula | C12H15NO3 |
| Molecular Weight | 221.1052 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.1052 Da |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
| SMILES | CCOC(=O)C(=O)NC(C)C1=CC=CC=C1 |
| InChIKey | AZAFKJXSVRFGNK-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl oxo[(1-phenylethyl)amino]acetate. With a topological polar surface area (TPSA) of 55.4 Ų, Ethyl oxo[(1-phenylethyl)amino]acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl oxo[(1-phenylethyl)amino]acetate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethyl oxo[(1-phenylethyl)amino]acetate is 1398512-13-4.
The molecular formula of Ethyl oxo[(1-phenylethyl)amino]acetate is C12H15NO3.
The molecular weight of Ethyl oxo[(1-phenylethyl)amino]acetate is 221.1052 g/mol.
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