321998-81-6
Product Name:
4-(2-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]amino)ethyl)-9-hydroxy-3,5-dioxo-4-azatricyclo[5.2.1.0(2,6)]decane-8-carbonitrile
Formula:
C18H16ClF3N4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 428.8 g/mol |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 428.0863026 g/mol |
| Monoisotopic Mass | 428.0863026 g/mol |
| Topological Polar Surface Area | 106 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 756 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 6 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |