309286-02-0
Product Name:
N-[1-(1-adamantyl)ethyl]-2-{[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]sulfanyl}acetamide
Formula:
C27H28F3N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 499.6 g/mol |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 6 |
| Exact Mass | 499.19051818 g/mol |
| Monoisotopic Mass | 499.19051818 g/mol |
| Topological Polar Surface Area | 91.1 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 792 |
| 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 |