AC1LOLBM
2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide
Also Known As: 2-((4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-chloro-5-(trifluoromethyl)phenyl)acetamide|F2649-0048|SR-01000284325-1|2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide|2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide|2-(4-amino-5-(3-pyridyl)(1,2,4-triazol-3-ylthio))-N-[2-chloro-5-(trifluorometh yl)phenyl]acetamide|N-[2-chloro-5-(trifluoromethyl)phenyl][4-amino-5-(3-pyridyl)-4H-1,2,4-triazol-3-ylthio]acetamide
| Molecular Formula | C16H12ClF3N6OS |
|---|---|
| Molecular Weight | 428.0434 g/mol |
| LogP | 3.4569 |
| Topological Polar Surface Area | 98.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.0434 |
| Monoisotopic Mass | 428.0434 |
| Heavy Atoms | 28 |
| Complexity | 995.7898 |
Chemical Identifiers
| CAS Number | 577700-13-1 |
|---|---|
| SMILES | C1=CC(=CN=C1)C2=NN=C(N2N)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
AC1LOLBM (CAS 577700-13-1), with molecular formula C16H12ClF3N6OS and molecular weight 428.0434 g/mol. IUPAC: 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-chloro-5-(trifluoromethyl)phenyl]acetamide.