AC1MNWMF
ethyl 2-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Also Known As: Oprea1_804634|F0539-0350|ethyl 2-(4-(azepan-1-ylsulfonyl)benzamido)-6-ethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate|ethyl 2-[4-(azepane-1-sulfonyl)benzamido]-6-ethyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate|ethyl 2-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
| Molecular Formula | C25H33N3O5S2 |
|---|---|
| Molecular Weight | 519.18616 g/mol |
| LogP | 4.1198 |
| Topological Polar Surface Area | 96.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 519.18616 |
| Monoisotopic Mass | 519.18616 |
| Heavy Atoms | 35 |
| Complexity | 1166.4543 |
Chemical Identifiers
| CAS Number | 449767-66-2 |
|---|---|
| SMILES | CCN1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4 |
Product Overview
AC1MNWMF (CAS 449767-66-2), with molecular formula C25H33N3O5S2 and molecular weight 519.18616 g/mol. IUPAC: ethyl 2-[[4-(azepan-1-ylsulfonyl)benzoyl]amino]-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate.
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