AC1LKN9F
ethyl 4-[[2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: AN-698/41886114|ethyl 4-[({[4-ethyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate|ethyl 4-[[2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate|ethyl 4-(2-((4-ethyl-5-(m-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate
CAS: 665017-20-9
| Molecular Formula | C22H24N4O3S |
|---|---|
| Molecular Weight | 424.15692 g/mol |
| LogP | 4.18092 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 424.15692 |
| Monoisotopic Mass | 424.15692 |
| Heavy Atoms | 30 |
| Complexity | 1031.1168 |
Chemical Identifiers
| CAS Number | 665017-20-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OCC)C3=CC=CC(=C3)C |
Product Overview
AC1LKN9F (CAS 665017-20-9), with molecular formula C22H24N4O3S and molecular weight 424.15692 g/mol. IUPAC: ethyl 4-[[2-[[4-ethyl-5-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate.
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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