AC1NC6MW
N-(1,1-dioxothiolan-3-yl)-2-[(4-fluorobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-{[(4-fluorophenyl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-fluorobenzamido)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide|N-(1,1-dioxothiolan-3-yl)-2-[(4-fluorobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C21H23FN2O4S2 |
|---|---|
| Molecular Weight | 450.10834 g/mol |
| LogP | 3.1812 |
| Topological Polar Surface Area | 92.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.10834 |
| Monoisotopic Mass | 450.10834 |
| Heavy Atoms | 30 |
| Complexity | 1092.9548 |
Chemical Identifiers
| CAS Number | 845807-91-2 |
|---|---|
| SMILES | CC1CCC2=C(C1)SC(=C2C(=O)NC3CCS(=O)(=O)C3)NC(=O)C4=CC=C(C=C4)F |
Product Overview
AC1NC6MW (CAS 845807-91-2), with molecular formula C21H23FN2O4S2 and molecular weight 450.10834 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-2-[(4-fluorobenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
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