AC1LKPQQ
ethyl 4-(2,5-dimethylphenyl)-2-[(3-methylthiophene-2-carbonyl)amino]thiophene-3-carboxylate
Also Known As: AK-968/41023091|ethyl 4-(2,5-dimethylphenyl)-2-[(3-methylthiophene-2-carbonyl)amino]thiophene-3-carboxylate|ethyl 4-(2,5-dimethylphenyl)-2-{[(3-methyl-2-thienyl)carbonyl]amino}-3-thiophenecarboxylate|ethyl 4-(2,5-dimethylphenyl)-2-(3-methylthiophene-2-carboxamido)thiophene-3-carboxylate|ethyl 4-(2,5-dimethylphenyl)-2-[(3-methyl(2-thienyl))carbonylamino]thiophene-3 -carboxylate|ethyl 4-(2,5-dimethylphenyl)-2-{[(3-methylthiophen-2-yl)carbonyl]amino}thiophene-3-carboxylate
| Molecular Formula | C21H21NO3S2 |
|---|---|
| Molecular Weight | 399.09628 g/mol |
| LogP | 5.83086 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.09628 |
| Monoisotopic Mass | 399.09628 |
| Heavy Atoms | 27 |
| Complexity | 1000.77795 |
Chemical Identifiers
| CAS Number | 445232-85-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=C(C=CC(=C2)C)C)NC(=O)C3=C(C=CS3)C |
Product Overview
AC1LKPQQ (CAS 445232-85-9), with molecular formula C21H21NO3S2 and molecular weight 399.09628 g/mol. IUPAC: ethyl 4-(2,5-dimethylphenyl)-2-[(3-methylthiophene-2-carbonyl)amino]thiophene-3-carboxylate.