AC1M3H52
methyl 2-[[2-[[4-ethyl-5-[(4-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
Also Known As: methyl 2-{[({4-ethyl-5-[(4-methoxyphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate|methyl 2-(2-((4-ethyl-5-((4-methoxyphenoxy)methyl)-4H-1,2,4-triazol-3-yl)thio)acetamido)benzoate|methyl 2-[[2-[[4-ethyl-5-[(4-methoxyphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]benzoate
CAS: 708243-40-7
| Molecular Formula | C22H24N4O5S |
|---|---|
| Molecular Weight | 456.14673 g/mol |
| LogP | 3.403 |
| Topological Polar Surface Area | 104.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 456.14673 |
| Monoisotopic Mass | 456.14673 |
| Heavy Atoms | 32 |
| Complexity | 1068.4381 |
Chemical Identifiers
| CAS Number | 708243-40-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(=O)OC)COC3=CC=C(C=C3)OC |
Product Overview
AC1M3H52 (CAS 708243-40-7), with molecular formula C22H24N4O5S and molecular weight 456.14673 g/mol. IUPAC: methyl 2-[[2-[[4-ethyl-5-[(4-methoxyphenoxy)methyl]-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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