Methyl 4-(2,4-dimethylphenyl)-2-({4-nitrobenzoyl}amino)-3-thiophenecarboxylate
methyl 4-(2,4-dimethylphenyl)-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate
Also Known As: AK-968/41026587|methyl 4-(2,4-dimethylphenyl)-2-({4-nitrobenzoyl}amino)-3-thiophenecarboxylate|methyl 4-(2,4-dimethylphenyl)-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate|METHYL 4-(2,4-DIMETHYLPHENYL)-2-(4-NITROBENZAMIDO)THIOPHENE-3-CARBOXYLATE|methyl 4-(2,4-dimethylphenyl)-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carb oxylate|methyl 4-(2,4-dimethylphenyl)-2-{[(4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C21H18N2O5S |
|---|---|
| Molecular Weight | 410.09363 g/mol |
| LogP | 4.97904 |
| Topological Polar Surface Area | 98.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 410.09363 |
| Monoisotopic Mass | 410.09363 |
| Heavy Atoms | 29 |
| Complexity | 1102.7593 |
Chemical Identifiers
| CAS Number | 445258-34-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C |
Product Overview
Methyl 4-(2,4-dimethylphenyl)-2-({4-nitrobenzoyl}amino)-3-thiophenecarboxylate (CAS 445258-34-4), with molecular formula C21H18N2O5S and molecular weight 410.09363 g/mol. IUPAC: methyl 4-(2,4-dimethylphenyl)-2-[(4-nitrobenzoyl)amino]thiophene-3-carboxylate.