AC1M35QG
2-[[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide
Also Known As: AN-584/43493880|2-{[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-3-nitrophenyl)acetamide|2-[[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide
CAS: 831252-52-9
| Molecular Formula | C21H19N5O5S |
|---|---|
| Molecular Weight | 453.1107 g/mol |
| LogP | 4.18432 |
| Topological Polar Surface Area | 125.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 453.1107 |
| Monoisotopic Mass | 453.1107 |
| Heavy Atoms | 32 |
| Complexity | 1329.6166 |
Chemical Identifiers
| CAS Number | 831252-52-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC4=C(O3)C(=CC=C4)OC)[N+](=O)[O-] |
Product Overview
AC1M35QG (CAS 831252-52-9), with molecular formula C21H19N5O5S and molecular weight 453.1107 g/mol. IUPAC: 2-[[5-(7-methoxy-1-benzofuran-2-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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