883956-89-6
Product Name:
(2Z)-2-(6,7-dimethoxy-3,4-dihydro-2H-isoquinolin-1-ylidene)-1-(2,3,5-trifluoro-4-imidazol-1-ylphenyl)ethanone
Formula:
C22H18F3N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 429.4 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 429.13002593 g/mol |
| Monoisotopic Mass | 429.13002593 g/mol |
| Topological Polar Surface Area | 65.4 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 682 |
| 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 |