AC1MTB4K
N-(4-butan-2-ylphenyl)-2-[[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-[4-(butan-2-yl)phenyl]-2-{[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|2-[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)(1,2,4-triazol-3-ylthio)]-N-[4-(methy lpropyl)phenyl]acetamide|N-(4-(sec-butyl)phenyl)-2-((4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(4-butan-2-ylphenyl)-2-[[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C29H32N4O3S |
|---|---|
| Molecular Weight | 516.2195 g/mol |
| LogP | 6.5859 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 516.2195 |
| Monoisotopic Mass | 516.2195 |
| Heavy Atoms | 37 |
| Complexity | 1302.7485 |
Chemical Identifiers
| CAS Number | 849005-87-4 |
|---|---|
| SMILES | CCC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OCC)C4=CC=C(C=C4)OC |
Product Overview
AC1MTB4K (CAS 849005-87-4), with molecular formula C29H32N4O3S and molecular weight 516.2195 g/mol. IUPAC: N-(4-butan-2-ylphenyl)-2-[[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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