AC1LJJE9
ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(2-oxochromene-3-carbonyl)amino]thiophene-3-carboxylate
Also Known As: Oprea1_607187|AK-968/41926735|ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(2-oxochromene-3-carbonyl)amino]thiophene-3-carboxylate|ethyl 5-(diethylcarbamoyl)-4-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}thiophene-3-carboxylate|ethyl 5-(diethylcarbamoyl)-4-methyl-2-(2-oxo-2H-chromene-3-carboxamido)thiophene-3-carboxylate|ethyl 5-(N,N-diethylcarbamoyl)-4-methyl-2-[(2-oxochromen-3-yl)carbonylamino]th iophene-3-carboxylate|ethyl 5-[(diethylamino)carbonyl]-4-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-thiophenecarboxylate
| Molecular Formula | C23H24N2O6S |
|---|---|
| Molecular Weight | 456.1355 g/mol |
| LogP | 4.07392 |
| Topological Polar Surface Area | 105.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.1355 |
| Monoisotopic Mass | 456.1355 |
| Heavy Atoms | 32 |
| Complexity | 1239.0027 |
Chemical Identifiers
| CAS Number | 545352-75-8 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=CC=CC=C3OC2=O)C(=O)OCC)C |
Product Overview
AC1LJJE9 (CAS 545352-75-8), with molecular formula C23H24N2O6S and molecular weight 456.1355 g/mol. IUPAC: ethyl 5-(diethylcarbamoyl)-4-methyl-2-[(2-oxochromene-3-carbonyl)amino]thiophene-3-carboxylate.