AC1N50HE
propan-2-yl 2-[(2,2-dichloro-1-methylcyclopropanecarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: AK-968/40731957|isopropyl 2-{[(2,2-dichloro-1-methylcyclopropyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|propan-2-yl 2-[(2,2-dichloro-1-methylcyclopropanecarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|propan-2-yl 2-{[(2,2-dichloro-1-methylcyclopropyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|isopropyl 2-(2,2-dichloro-1-methylcyclopropanecarboxamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|methylethyl 2-[(2,2-dichloro-1-methylcyclopropyl)carbonylamino]-4,5,6,7-tetrah ydrobenzo[b]thiophene-3-carboxylate
| Molecular Formula | C17H21Cl2NO3S |
|---|---|
| Molecular Weight | 389.06192 g/mol |
| LogP | 4.7145 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.06192 |
| Monoisotopic Mass | 389.06192 |
| Heavy Atoms | 24 |
| Complexity | 698.2529 |
Chemical Identifiers
| CAS Number | 445017-62-9 |
|---|---|
| SMILES | CC(C)OC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3(CC3(Cl)Cl)C |
Product Overview
AC1N50HE (CAS 445017-62-9), with molecular formula C17H21Cl2NO3S and molecular weight 389.06192 g/mol. IUPAC: propan-2-yl 2-[(2,2-dichloro-1-methylcyclopropanecarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.