AC1MEXAT
methyl 6-tert-butyl-2-(pyridine-4-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Oprea1_385290|Oprea1_854939|AK-968/11993046|SR-01000217400-1|methyl 6-tert-butyl-2-(isonicotinoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 6-tert-butyl-2-(pyridine-4-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|methyl 6-(tert-butyl)-2-(4-pyridylcarbonylamino)-4,5,6,7-tetrahydrobenzo[b]thi ophene-3-carboxylate|methyl 6-(tert-butyl)-2-(isonicotinamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|methyl 6-tert-butyl-2-[(pyridin-4-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C20H24N2O3S |
|---|---|
| Molecular Weight | 372.15076 g/mol |
| LogP | 4.333 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.15076 |
| Monoisotopic Mass | 372.15076 |
| Heavy Atoms | 26 |
| Complexity | 821.5721 |
Chemical Identifiers
| CAS Number | 352679-75-5 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=CC=NC=C3 |
Product Overview
AC1MEXAT (CAS 352679-75-5), with molecular formula C20H24N2O3S and molecular weight 372.15076 g/mol. IUPAC: methyl 6-tert-butyl-2-(pyridine-4-carbonylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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