3-Methyl-2-((2-methylbenzyl)sulfanyl)-6-(trifluoromethyl)-4(3H)-pyrimidinone
3-methyl-2-[(2-methylphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one
Also Known As: KS-00003EGV|8J-514S|3-Methyl-2-((2-methylbenzyl)sulfanyl)-6-(trifluoromethyl)-4(3H)-pyrimidinone|3-methyl-2-[(2-methylphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one|3-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-6-(trifluoromethyl)-3,4-dihydropyrimidin-4-one|3-methyl-2-[(2-methylbenzyl)sulfanyl]-6-(trifluoromethyl)-4(3H)-pyrimidinone|3-Methyl-2-[[(2-methylphenyl)methyl]thio]-6-(trifluoromethyl)-4(3H)-pyrimidinone|3-Methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-6-(trifluoromethyl)pyrimidin-4(3H)-one
| Molecular Formula | C14H13F3N2OS |
|---|---|
| Molecular Weight | 314.07007 g/mol |
| LogP | 3.39982 |
| Topological Polar Surface Area | 34.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.07007 |
| Monoisotopic Mass | 314.07007 |
| Heavy Atoms | 21 |
| Complexity | 710.0958 |
Chemical Identifiers
| CAS Number | 339101-63-2 |
|---|---|
| SMILES | CC1=CC=CC=C1CSC2=NC(=CC(=O)N2C)C(F)(F)F |
Product Overview
3-Methyl-2-((2-methylbenzyl)sulfanyl)-6-(trifluoromethyl)-4(3H)-pyrimidinone (CAS 339101-63-2), with molecular formula C14H13F3N2OS and molecular weight 314.07007 g/mol. IUPAC: 3-methyl-2-[(2-methylphenyl)methylsulfanyl]-6-(trifluoromethyl)pyrimidin-4-one.