Dimethyl 3-methyl-5-{[(4-nitrophenoxy)acetyl]amino}thiophene-2,4-dicarboxylate
dimethyl 3-methyl-5-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylate
Also Known As: Oprea1_427648|AK-968/40708036|dimethyl 3-methyl-5-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylate|dimethyl 3-methyl-5-{[(4-nitrophenoxy)acetyl]amino}thiophene-2,4-dicarboxylate|dimethyl 3-methyl-5-(2-(4-nitrophenoxy)acetamido)thiophene-2,4-dicarboxylate|dimethyl 5-[({4-nitrophenoxy}acetyl)amino]-3-methylthiophene-2,4-dicarboxylate|methyl 4-(methoxycarbonyl)-3-methyl-5-[2-(4-nitrophenoxy)acetylamino]thiophene -2-carboxylate
| Molecular Formula | C17H16N2O8S |
|---|---|
| Molecular Weight | 408.06274 g/mol |
| LogP | 2.55542 |
| Topological Polar Surface Area | 134.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 408.06274 |
| Monoisotopic Mass | 408.06274 |
| Heavy Atoms | 28 |
| Complexity | 919.98376 |
Chemical Identifiers
| CAS Number | 445005-28-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)COC2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC |
Product Overview
Dimethyl 3-methyl-5-{[(4-nitrophenoxy)acetyl]amino}thiophene-2,4-dicarboxylate (CAS 445005-28-7), with molecular formula C17H16N2O8S and molecular weight 408.06274 g/mol. IUPAC: dimethyl 3-methyl-5-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylate.