338397-68-5
Product Name:
3-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-3-(4-METHOXYPHENYL)DIHYDRO-2,6(1H,3H)-PYRIDINEDIONE
Formula:
C18H14ClF3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 398.8 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 398.0645045 g/mol |
| Monoisotopic Mass | 398.0645045 g/mol |
| Topological Polar Surface Area | 68.3 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 581 |
| 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 |