725699-00-3
Product Name:
5-({[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]thio}methyl)-2-furoic acid
Formula:
C12H9F3N2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 318.27 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 318.02859781 g/mol |
| Monoisotopic Mass | 318.02859781 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 383 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |