338975-57-8
Product Name:
3-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 | 533 |
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 |