625408-97-1
Product Name:
5-HYDROXY-5-PYRIDIN-4-YL-3-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBALDEHYDE
Formula:
C10H8F3N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 259.18 g/mol |
|---|---|
| XLogP3 | 0.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 1 |
| Exact Mass | 259.05686099 g/mol |
| Monoisotopic Mass | 259.05686099 g/mol |
| Topological Polar Surface Area | 65.8 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 366 |
| 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 |