AC1LKQEQ
ethyl 2-[(5-bromo-2-chlorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: AK-968/41024859|ethyl 2-[(5-bromo-2-chlorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|ETHYL 2-(5-BROMO-2-CHLOROBENZAMIDO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE|ethyl 2-(5-bromo-2-chlorobenzamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate|ethyl 2-[(5-bromo-2-chlorophenyl)carbonylamino]-4,5,6-trihydrocyclopenta[2,1-b ]thiophene-3-carboxylate|ethyl 2-{[(5-bromo-2-chlorophenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C17H15BrClNO3S |
|---|---|
| Molecular Weight | 426.96445 g/mol |
| LogP | 5.0817 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.96445 |
| Monoisotopic Mass | 426.96445 |
| Heavy Atoms | 24 |
| Complexity | 818.4072 |
Chemical Identifiers
| CAS Number | 445239-22-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=C(C=CC(=C3)Br)Cl |
Product Overview
AC1LKQEQ (CAS 445239-22-5), with molecular formula C17H15BrClNO3S and molecular weight 426.96445 g/mol. IUPAC: ethyl 2-[(5-bromo-2-chlorobenzoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.