AC1LJOVA
methyl 2-[(3-ethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Oprea1_753855|AK-968/40734589|methyl 2-[(3-ethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 2-(3-ethoxybenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|methyl 2-[(3-ethoxyphenyl)carbonylamino]-4,5,6,7-tetrahydrobenzo[b]thiophene-3 -carboxylate|methyl 2-{[(3-ethoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C19H21NO4S |
|---|---|
| Molecular Weight | 359.11914 g/mol |
| LogP | 4.0645 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.11914 |
| Monoisotopic Mass | 359.11914 |
| Heavy Atoms | 25 |
| Complexity | 796.7169 |
Chemical Identifiers
| CAS Number | 445022-58-2 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC |
Product Overview
AC1LJOVA (CAS 445022-58-2), with molecular formula C19H21NO4S and molecular weight 359.11914 g/mol. IUPAC: methyl 2-[(3-ethoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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