AC1M0MDS
2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: 2-{[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide|2-((5-(thiophen-2-ylmethyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-(trifluoromethyl)phenyl)acetamide|2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide|2-[4-(4-methylphenyl)-5-(2-thienylmethyl)(1,2,4-triazol-3-ylthio)]-N-[2-(trifl uoromethyl)phenyl]acetamide
| Molecular Formula | C23H19F3N4OS2 |
|---|---|
| Molecular Weight | 488.09525 g/mol |
| LogP | 5.97762 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 488.09525 |
| Monoisotopic Mass | 488.09525 |
| Heavy Atoms | 33 |
| Complexity | 1235.5874 |
Chemical Identifiers
| CAS Number | 899403-46-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3C(F)(F)F)CC4=CC=CS4 |
Product Overview
AC1M0MDS (CAS 899403-46-4), with molecular formula C23H19F3N4OS2 and molecular weight 488.09525 g/mol. IUPAC: 2-[[4-(4-methylphenyl)-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide.