AC1LQP8M
ethyl 2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Oprea1_368764|SR-01000397035-1|F0016-0590|ethyl 2-(4-(pyrrolidin-1-ylsulfonyl)benzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ETHYL 2-[4-(PYRROLIDINE-1-SULFONYL)BENZAMIDO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE|ethyl 2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-{[4-(pyrrolidinylsulfonyl)phenyl]carbonylamino}-4,5,6,7-tetrahydrobenz o[b]thiophene-3-carboxylate
| Molecular Formula | C22H26N2O5S2 |
|---|---|
| Molecular Weight | 462.12833 g/mol |
| LogP | 3.8404 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.12833 |
| Monoisotopic Mass | 462.12833 |
| Heavy Atoms | 31 |
| Complexity | 1083.8497 |
Chemical Identifiers
| CAS Number | 321967-75-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4 |
Product Overview
AC1LQP8M (CAS 321967-75-3), with molecular formula C22H26N2O5S2 and molecular weight 462.12833 g/mol. IUPAC: ethyl 2-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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