318498-01-0
Product Name:
3-[1-(3-NITROPHENYL)-1H-PYRAZOL-3-YL]-1-[3-(TRIFLUOROMETHYL)PHENYL]-4(1H)-PYRIDAZINONE
Formula:
C20H12F3N5O3
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COMPUTED DESCRIPTORS
Molecular Weight | 427.3 g/mol |
---|---|
XLogP3 | 4.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 3 |
Exact Mass | 427.08922375 g/mol |
Monoisotopic Mass | 427.08922375 g/mol |
Topological Polar Surface Area | 96.3 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 766 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |