AC1M2EG0
methyl 2-[(5-chloro-2-nitrobenzoyl)amino]-4-(4-chlorophenyl)thiophene-3-carboxylate
Also Known As: Oprea1_304421|AK-968/41926306|methyl 2-({5-chloro-2-nitrobenzoyl}amino)-4-(4-chlorophenyl)-3-thiophenecarboxylate|methyl 2-[(5-chloro-2-nitrobenzoyl)amino]-4-(4-chlorophenyl)thiophene-3-carboxylate|METHYL 2-(5-CHLORO-2-NITROBENZAMIDO)-4-(4-CHLOROPHENYL)THIOPHENE-3-CARBOXYLATE|methyl 2-[(5-chloro-2-nitrophenyl)carbonylamino]-4-(4-chlorophenyl)thiophene-3 -carboxylate|methyl 2-{[(5-chloro-2-nitrophenyl)carbonyl]amino}-4-(4-chlorophenyl)thiophene-3-carboxylate
| Molecular Formula | C19H12Cl2N2O5S |
|---|---|
| Molecular Weight | 449.9844 g/mol |
| LogP | 5.669 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.9844 |
| Monoisotopic Mass | 449.9844 |
| Heavy Atoms | 29 |
| Complexity | 1112.2874 |
Chemical Identifiers
| CAS Number | 545441-01-8 |
|---|---|
| SMILES | COC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-] |
Product Overview
AC1M2EG0 (CAS 545441-01-8), with molecular formula C19H12Cl2N2O5S and molecular weight 449.9844 g/mol. IUPAC: methyl 2-[(5-chloro-2-nitrobenzoyl)amino]-4-(4-chlorophenyl)thiophene-3-carboxylate.