AC1NRO2E
2-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)acetamide
Also Known As: 2-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)acetamide|2-{[4-Benzyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[(2-methylpropyl)carbamoyl]acetamide
CAS: 5741-97-9
| Molecular Formula | C22H24FN5O2S |
|---|---|
| Molecular Weight | 441.16348 g/mol |
| LogP | 3.7064 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 441.16348 |
| Monoisotopic Mass | 441.16348 |
| Heavy Atoms | 31 |
| Complexity | 1022.1403 |
Chemical Identifiers
| CAS Number | 5741-97-9 |
|---|---|
| SMILES | CC(C)CNC(=O)NC(=O)CSC1=NN=C(N1CC2=CC=CC=C2)C3=CC=C(C=C3)F |
Product Overview
AC1NRO2E (CAS 5741-97-9), with molecular formula C22H24FN5O2S and molecular weight 441.16348 g/mol. IUPAC: 2-[[4-benzyl-5-(4-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylpropylcarbamoyl)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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