722468-39-5
Product Name:
3-Pyridinecarboxylic acid, 2-(methylthio)-, 2-oxo-2-[[2-(trifluoromethyl)phenyl]amino]ethyl ester
Formula:
C16H13F3N2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 370.3 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 370.05989794 g/mol |
| Monoisotopic Mass | 370.05989794 g/mol |
| Topological Polar Surface Area | 93.6 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 476 |
| 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 |