338975-58-9
Product Name:
4-CHLORO-N'-([5-OXO-3-(TRIFLUOROMETHYL)-1,5-DIHYDRO-4H-PYRAZOL-4-YLIDEN]METHYL)BENZENECARBOHYDRAZIDE
Formula:
C12H8ClF3N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 332.66 g/mol |
|---|---|
| XLogP3 | 2.4 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 332.0287877 g/mol |
| Monoisotopic Mass | 332.0287877 g/mol |
| Topological Polar Surface Area | 82.6 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 525 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |