AC1LXT9Q
N-(3-chloro-4-fluorophenyl)-2-[[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(3-chloro-4-fluorophenyl)-2-{[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(3-chloro-4-fluorophenyl)-2-((4-(4-ethoxyphenyl)-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(3-chloro-4-fluorophenyl)-2-[[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-chloro-4-fluorophenyl)-2-[4-(4-ethoxyphenyl)-5-(phenoxymethyl)(1,2,4-tria zol-3-ylthio)]acetamide
| Molecular Formula | C25H22ClFN4O3S |
|---|---|
| Molecular Weight | 512.1085 g/mol |
| LogP | 5.7683 |
| Topological Polar Surface Area | 78.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 512.1085 |
| Monoisotopic Mass | 512.1085 |
| Heavy Atoms | 35 |
| Complexity | 1285.8789 |
Chemical Identifiers
| CAS Number | 896809-54-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=C(C=C3)F)Cl)COC4=CC=CC=C4 |
Product Overview
AC1LXT9Q (CAS 896809-54-4), with molecular formula C25H22ClFN4O3S and molecular weight 512.1085 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2-[[4-(4-ethoxyphenyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide.