AC1LWCVK
ethyl 2-[(3-bromobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Also Known As: Oprea1_001375|F0817-0345|AE-848/13008263|ethyl 2-[(3-bromobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|SR-01000463335-1|ETHYL 2-(3-BROMOBENZAMIDO)-4H,5H,6H,7H,8H-CYCLOHEPTA[B]THIOPHENE-3-CARBOXYLATE|A2566/0109332|ethyl 2-(3-bromobenzamido)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate|ethyl 2-(m-bromobenzylamino)-1-thia-5,6,7,8-tetrahydro-4H-azulene-3-carboxylate|ethyl 2-{[(3-bromophenyl)carbonyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
| Molecular Formula | C19H20BrNO3S |
|---|---|
| Molecular Weight | 421.03473 g/mol |
| LogP | 5.2085 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.03473 |
| Monoisotopic Mass | 421.03473 |
| Heavy Atoms | 25 |
| Complexity | 799.96204 |
Chemical Identifiers
| CAS Number | 397290-58-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=O)C3=CC(=CC=C3)Br |
Product Overview
AC1LWCVK (CAS 397290-58-3), with molecular formula C19H20BrNO3S and molecular weight 421.03473 g/mol. IUPAC: ethyl 2-[(3-bromobenzoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate.
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