AC1MRFO4
ethyl 2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Oprea1_665546|AK-968/41017731|ethyl 2-{[(2-chloro-6-fluorophenyl)acetyl]amino}-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-(2-(2-chloro-6-fluorophenyl)acetamido)-6-ethyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ethyl 2-[2-(6-chloro-2-fluorophenyl)acetylamino]-6-ethyl-4,5,6,7-tetrahydroben zo[b]thiophene-3-carboxylate
| Molecular Formula | C21H23ClFNO3S |
|---|---|
| Molecular Weight | 423.10712 g/mol |
| LogP | 5.4134 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.10712 |
| Monoisotopic Mass | 423.10712 |
| Heavy Atoms | 28 |
| Complexity | 875.7661 |
Chemical Identifiers
| CAS Number | 438212-93-2 |
|---|---|
| SMILES | CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)CC3=C(C=CC=C3Cl)F |
Product Overview
AC1MRFO4 (CAS 438212-93-2), with molecular formula C21H23ClFNO3S and molecular weight 423.10712 g/mol. IUPAC: ethyl 2-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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