AC1LK9SX
propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate
Also Known As: AK-968/40708851|propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate|isopropyl 4-(4-fluorophenyl)-2-[({4-nitrophenoxy}acetyl)amino]thiophene-3-carboxylate|methylethyl 4-(4-fluorophenyl)-2-[2-(4-nitrophenoxy)acetylamino]thiophene-3-ca rboxylate|propan-2-yl 4-(4-fluorophenyl)-2-{[(4-nitrophenoxy)acetyl]amino}thiophene-3-carboxylate
| Molecular Formula | C22H19FN2O6S |
|---|---|
| Molecular Weight | 458.0948 g/mol |
| LogP | 5.0451 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.0948 |
| Monoisotopic Mass | 458.0948 |
| Heavy Atoms | 32 |
| Complexity | 1126.3278 |
Chemical Identifiers
| CAS Number | 445007-52-3 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)COC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
AC1LK9SX (CAS 445007-52-3), with molecular formula C22H19FN2O6S and molecular weight 458.0948 g/mol. IUPAC: propan-2-yl 4-(4-fluorophenyl)-2-[[2-(4-nitrophenoxy)acetyl]amino]thiophene-3-carboxylate.
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