338975-91-0
Product Name:
4-Oxo-N-phenyl-3-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1-phthalazinecarboxamide
Formula:
C22H14F3N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 409.4 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 409.10381118 g/mol |
| Monoisotopic Mass | 409.10381118 g/mol |
| Topological Polar Surface Area | 61.8 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 688 |
| 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 |