AC1OZ2WK
5,7-dimethyl-3-[[1-[3-(trifluoromethyl)phenyl]tetrazol-5-yl]methylsulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidine
Also Known As: 5,7-dimethyl-3-[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}methyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrimidine|5,7-dimethyl-3-(((1-(3-(trifluoromethyl)phenyl)-1H-tetrazol-5-yl)methyl)thio)-[1,2,4]triazolo[4,3-a]pyrimidine|5,7-dimethyl-3-[[1-[3-(trifluoromethyl)phenyl]tetrazol-5-yl]methylsulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidine|5-[({5,7-DIMETHYL-[1,2,4]TRIAZOLO[4,3-A]PYRIMIDIN-3-YL}SULFANYL)METHYL]-1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-1,2,3,4-TETRAZOLE
| Molecular Formula | C16H13F3N8S |
|---|---|
| Molecular Weight | 406.0936 g/mol |
| LogP | 3.02794 |
| Topological Polar Surface Area | 86.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.0936 |
| Monoisotopic Mass | 406.0936 |
| Heavy Atoms | 28 |
| Complexity | 1150.4558 |
Chemical Identifiers
| CAS Number | 898652-99-8 |
|---|---|
| SMILES | CC1=CC(=NC2=NN=C(N12)SCC3=NN=NN3C4=CC=CC(=C4)C(F)(F)F)C |
Product Overview
AC1OZ2WK (CAS 898652-99-8), with molecular formula C16H13F3N8S and molecular weight 406.0936 g/mol. IUPAC: 5,7-dimethyl-3-[[1-[3-(trifluoromethyl)phenyl]tetrazol-5-yl]methylsulfanyl]-[1,2,4]triazolo[4,3-a]pyrimidine.
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