AC1Q2KOA
N-(2,4-difluorophenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(2,4-difluorophenyl)-2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(2,4-difluorophenyl)-2-((5-(thiophen-2-ylmethyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(2,4-difluorophenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(2,4-difluorophenyl)-2-[4-(4-methylphenyl)-5-(2-thienylmethyl)(1,2,4-triazol -3-ylthio)]acetamide
| Molecular Formula | C22H18F2N4OS2 |
|---|---|
| Molecular Weight | 456.08902 g/mol |
| LogP | 5.23702 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.08902 |
| Monoisotopic Mass | 456.08902 |
| Heavy Atoms | 31 |
| Complexity | 1190.9586 |
Chemical Identifiers
| CAS Number | 896803-99-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)F)F)CC4=CC=CS4 |
Product Overview
AC1Q2KOA (CAS 896803-99-9), with molecular formula C22H18F2N4OS2 and molecular weight 456.08902 g/mol. IUPAC: N-(2,4-difluorophenyl)-2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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