830346-50-4
Product Name:
3-[(2R)-2-Amino-2-phenylethyl]-5-(2-fluoro-3-methoxyphenyl)-1-[[2-fluoro-6-(trifluoromethyl)phenyl]methyl]-6-methyl-2,4(1H,3H)-pyrimidinedione
Formula:
C28H24F5N3O3
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COMPUTED DESCRIPTORS
Molecular Weight | 545.5 g/mol |
---|---|
XLogP3 | 4.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 9 |
Rotatable Bond Count | 7 |
Exact Mass | 545.17378245 g/mol |
Monoisotopic Mass | 545.17378245 g/mol |
Topological Polar Surface Area | 75.9 Ų |
Heavy Atom Count | 39 |
Formal Charge | 0 |
Complexity | 923 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 1 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |