TL;DR: Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate (CAS 154640-54-7) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-(2-oxoquinoxalin-1-yl)acetate
Also Known As: ethyl 2-(2-oxoquinoxalin-1-yl)acetate, ethyl 2-(2-oxo-1,2-dihydroquinoxalin-1-yl)acetate, Ethyl 2-(2-oxoquinoxalin-1(2H)-yl)acetate, 2K-329S, ethyl 2-(3-oxo-3,4-dihydro-4-quinolinyl)acetate
| Molecular Formula | C12H12N2O3 |
| Molecular Weight | 232.0848 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.0848 Da |
| Heavy Atoms | 17 |
| Complexity | 341.0 |
| SMILES | CCOC(=O)CN1C2=CC=CC=C2N=CC1=O |
| InChIKey | NFWMSGZOFCQKCT-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate. With a topological polar surface area (TPSA) of 59.0 Ų, Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate has 0 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 Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate is 154640-54-7.
The molecular formula of Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate is C12H12N2O3.
The molecular weight of Ethyl (2-oxo-1(2H)-quinoxalinyl)acetate is 232.0848 g/mol.
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