AC1LMH6Z
ethyl 4-[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate
Also Known As: BAS 02325404|AG-690/40754089|ethyl 4-({[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate|ethyl 4-[2-(4-ethyl-5-phenyl-1,2,4-triazol-3-ylthio)acetylamino]benzoate|ethyl 4-(2-((4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|ethyl 4-[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate|ETHYL 4-({2-[(4-ETHYL-5-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL]ACETYL}AMINO)BENZOATE
CAS: 485334-10-9
| Molecular Formula | C21H22N4O3S |
|---|---|
| Molecular Weight | 410.14127 g/mol |
| LogP | 3.8725 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.14127 |
| Monoisotopic Mass | 410.14127 |
| Heavy Atoms | 29 |
| Complexity | 971.3511 |
Chemical Identifiers
| CAS Number | 485334-10-9 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)OCC)C3=CC=CC=C3 |
Product Overview
AC1LMH6Z (CAS 485334-10-9), with molecular formula C21H22N4O3S and molecular weight 410.14127 g/mol. IUPAC: ethyl 4-[[2-[(4-ethyl-5-phenyl-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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