946387-27-5
Product Name:
2-(((4-(3-Chloro-5-(trifluoromethyl)(2-pyridyloxy))phenyl)amino)methylene)-5-methylcyclohexane-1,3-dione
Formula:
C20H16ClF3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 424.8 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 4 |
| Exact Mass | 424.0801546 g/mol |
| Monoisotopic Mass | 424.0801546 g/mol |
| Topological Polar Surface Area | 71.8 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 660 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |