AC1MK93M
N-(1,1-dioxothiolan-3-yl)-2-[(3-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BAS 06261216|N-(1,1-DIOXIDOTETRAHYDRO-3-THIENYL)-2-[(3-METHOXYBENZOYL)AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE|N-(1,1-Dioxidotetrahydrothiophen-3-yl)-2-(3-methoxybenzamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide|N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-{[(3-methoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|N-(1,1-dioxothiolan-3-yl)-2-[(3-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|N-(1,1-dioxothiolan-3-yl){2-[(3-methoxyphenyl)carbonylamino](4,5,6,7-tetrahydr obenzo[b]thiophen-3-yl)}carboxamide
| Molecular Formula | C21H24N2O5S2 |
|---|---|
| Molecular Weight | 448.11267 g/mol |
| LogP | 2.8047 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.11267 |
| Monoisotopic Mass | 448.11267 |
| Heavy Atoms | 30 |
| Complexity | 1090.8115 |
Chemical Identifiers
| CAS Number | 618079-06-4 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4CCS(=O)(=O)C4 |
Product Overview
AC1MK93M (CAS 618079-06-4), with molecular formula C21H24N2O5S2 and molecular weight 448.11267 g/mol. IUPAC: N-(1,1-dioxothiolan-3-yl)-2-[(3-methoxybenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.