311328-69-5
Product Name:
2-amino-4-(3,4-dimethoxyphenyl)-7,7-dimethyl-5-oxo-1-[3-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
Formula:
C27H26F3N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 497.5 g/mol |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 497.19262619 g/mol |
| Monoisotopic Mass | 497.19262619 g/mol |
| Topological Polar Surface Area | 88.6 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 993 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |