AC1N2SBA
methyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]thiophene-3-carboxylate
Also Known As: Oprea1_441859|F0526-2034|methyl 5-(benzo[d][1,3]dioxol-5-ylmethyl)-4-methyl-2-(4-(N-methyl-N-phenylsulfamoyl)benzamido)thiophene-3-carboxylate|methyl 5-[(2H-1,3-benzodioxol-5-yl)methyl]-4-methyl-2-{4-[methyl(phenyl)sulfamoyl]benzamido}thiophene-3-carboxylate|methyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]thiophene-3-carboxylate|methyl 5-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[p-(N-methyl-N-phenylaminosulfonyl)benzylamino]-4-methyl-3-thenoate
| Molecular Formula | C29H26N2O7S2 |
|---|---|
| Molecular Weight | 578.11816 g/mol |
| LogP | 5.24002 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 578.11816 |
| Monoisotopic Mass | 578.11816 |
| Heavy Atoms | 40 |
| Complexity | 1681.5475 |
Chemical Identifiers
| CAS Number | 476366-29-7 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C3=CC=CC=C3)CC4=CC5=C(C=C4)OCO5 |
Product Overview
AC1N2SBA (CAS 476366-29-7), with molecular formula C29H26N2O7S2 and molecular weight 578.11816 g/mol. IUPAC: methyl 5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[4-[methyl(phenyl)sulfamoyl]benzoyl]amino]thiophene-3-carboxylate.