289042-12-2
Product Name:
tert-Butyl 6-[(1E)-2-[4-(4-fluorophenyl)-6-(1-methylethyl)-2-[methyl(methylsulfonyl)amino]-5-pyrimidinyl]ethenyl]-2,2-dimethyl-1,3-dioxane-4-acetate
Formula:
C29H40FN3O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 577.7 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 10 |
| Exact Mass | 577.26218534 g/mol |
| Monoisotopic Mass | 577.26218534 g/mol |
| Topological Polar Surface Area | 116 Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 985 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |