338965-81-4
Product Name:
Ethyl 3-(4-methylphenyl)-5-([3-(trifluoromethyl)phenyl]sulfanyl)-1,2,4-triazine-6-carboxylate
Formula:
C20H16F3N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 419.4 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 419.09153242 g/mol |
| Monoisotopic Mass | 419.09153242 g/mol |
| Topological Polar Surface Area | 90.3 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 544 |
| 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 |