338403-26-2
Product Name:
Methyl 4-(([5-oxo-1-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)-1,5-dihydro-4H-pyrazol-4-yliden]methyl)amino)benzenecarboxylate
Formula:
C20H13F6N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 473.3 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 6 |
| Exact Mass | 473.08102488 g/mol |
| Monoisotopic Mass | 473.08102488 g/mol |
| Topological Polar Surface Area | 80.2 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 795 |
| 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 |