AC1NABIH
methyl 6-tert-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: methyl 6-tert-butyl-2-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|SR-01000039793-1|methyl 6-tert-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|METHYL 6-TERT-BUTYL-2-[(1,1-DIOXO-1??,2-BENZOTHIAZOL-3-YL)AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE|METHYL 6-(TERT-BUTYL)-2-[(1,1-DIOXO-1H-1,2-BENZISOTHIAZOL-3-YL)AMINO]-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE|methyl 6-tert-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
| Molecular Formula | C21H24N2O4S2 |
|---|---|
| Molecular Weight | 432.11774 g/mol |
| LogP | 4.2467 |
| Topological Polar Surface Area | 84.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 432.11774 |
| Monoisotopic Mass | 432.11774 |
| Heavy Atoms | 29 |
| Complexity | 1124.0353 |
Chemical Identifiers
| CAS Number | 565192-75-8 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC3=NS(=O)(=O)C4=CC=CC=C43 |
Product Overview
AC1NABIH (CAS 565192-75-8), with molecular formula C21H24N2O4S2 and molecular weight 432.11774 g/mol. IUPAC: methyl 6-tert-butyl-2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.