Isopropyl 2-({4-nitrobenzoyl}amino)-5-methyl-4-phenyl-3-thiophenecarboxylate
propan-2-yl 5-methyl-2-[(4-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate
Also Known As: AK-968/41026583|isopropyl 2-({4-nitrobenzoyl}amino)-5-methyl-4-phenyl-3-thiophenecarboxylate|propan-2-yl 5-methyl-2-[(4-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate|ISOPROPYL 5-METHYL-2-(4-NITROBENZAMIDO)-4-PHENYLTHIOPHENE-3-CARBOXYLATE|methylethyl 5-methyl-2-[(4-nitrophenyl)carbonylamino]-4-phenylthiophene-3-carb oxylate|propan-2-yl 5-methyl-2-{[(4-nitrophenyl)carbonyl]amino}-4-phenylthiophene-3-carboxylate
| Molecular Formula | C22H20N2O5S |
|---|---|
| Molecular Weight | 424.10928 g/mol |
| LogP | 5.44922 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.10928 |
| Monoisotopic Mass | 424.10928 |
| Heavy Atoms | 30 |
| Complexity | 1088.7206 |
Chemical Identifiers
| CAS Number | 445258-33-3 |
|---|---|
| SMILES | CC1=C(C(=C(S1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OC(C)C)C3=CC=CC=C3 |
Product Overview
Isopropyl 2-({4-nitrobenzoyl}amino)-5-methyl-4-phenyl-3-thiophenecarboxylate (CAS 445258-33-3), with molecular formula C22H20N2O5S and molecular weight 424.10928 g/mol. IUPAC: propan-2-yl 5-methyl-2-[(4-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate.