TL;DR: 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate (CAS 1002789-94-7) is a chemical compound with molecular formula C16H14N2O4S and molecular weight 330.0674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-thiophen-2-ylacetate
Also Known As: [2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 2-thiophen-2-ylacetate|2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate|2-Oxo-2-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)ethyl (thiophen-2-yl)acetate|Z19705120
| Molecular Formula | C16H14N2O4S |
| Molecular Weight | 330.0674 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 330.0674 Da |
| Heavy Atoms | 23 |
| Complexity | 485.0 |
| SMILES | C1C(=O)NC2=CC=CC=C2N1C(=O)COC(=O)CC3=CC=CS3 |
| InChIKey | XJEPTYCNOVHRRP-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate. Following Lipinski's Rule of Five, 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate has 1 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 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate is 1002789-94-7.
The molecular formula of 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate is C16H14N2O4S.
The molecular weight of 2-(3,4-Dihydro-3-oxo-1(2H)-quinoxalinyl)-2-oxoethyl 2-thiopheneacetate is 330.0674 g/mol.
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