Oprea1_496917
methyl 6-methyl-2-[(5-methylfuran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Oprea1_496917|AK-968/12343471|methyl 6-methyl-2-[(5-methylfuran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 6-methyl-2-[(5-methyl-2-furoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 6-methyl-2-{[(5-methylfuran-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 6-methyl-2-[(5-methyl(2-furyl))carbonylamino]-4,5,6,7-tetrahydrobenzo[b ]thiophene-3-carboxylate
| Molecular Formula | C17H19NO4S |
|---|---|
| Molecular Weight | 333.1035 g/mol |
| LogP | 3.81322 |
| Topological Polar Surface Area | 68.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.1035 |
| Monoisotopic Mass | 333.1035 |
| Heavy Atoms | 23 |
| Complexity | 758.73157 |
Chemical Identifiers
| CAS Number | 543714-68-7 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=C(O3)C |
Product Overview
Oprea1_496917 (CAS 543714-68-7), with molecular formula C17H19NO4S and molecular weight 333.1035 g/mol. IUPAC: methyl 6-methyl-2-[(5-methylfuran-2-carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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