945985-98-8
Product Name:
N-[3,5-bis(trifluoroMethyl)phenyl]-N'-(9R)-cinchonan-9-yl-Urea
Formula:
C28H26F6N4O
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COMPUTED DESCRIPTORS
| Molecular Weight | 548.5 g/mol |
|---|---|
| XLogP3 | 5.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 5 |
| Exact Mass | 548.20108044 g/mol |
| Monoisotopic Mass | 548.20108044 g/mol |
| Topological Polar Surface Area | 57.3 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 859 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |