AC1M0KTE
N-(3-chloro-2-methylphenyl)-2-[[5-(2-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(3-chloro-2-methylphenyl)-2-{[5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|N-(3-chloro-2-methyl-phenyl)-2-[[5-(2-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-chloro-2-methylphenyl)-2-((5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl)thio)acetamide|N-(3-chloro-2-methylphenyl)-2-[[5-(2-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide|N-(3-chloro-2-methylphenyl)-2-[5-(2-fluorophenyl)-4-phenyl(1,2,4-triazol-3-ylt hio)]acetamide
| Molecular Formula | C23H18ClFN4OS |
|---|---|
| Molecular Weight | 452.0874 g/mol |
| LogP | 5.76602 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.0874 |
| Monoisotopic Mass | 452.0874 |
| Heavy Atoms | 31 |
| Complexity | 1229.491 |
Chemical Identifiers
| CAS Number | 896804-07-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4F |
Product Overview
AC1M0KTE (CAS 896804-07-2), with molecular formula C23H18ClFN4OS and molecular weight 452.0874 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-2-[[5-(2-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.