1256245-86-9
Product Name:
3-[[3,5-bis(trifluoroMethyl)phenyl]aMino]-4-[(8α,9S)-cinchonan-9-ylaMino]-3-Cyclobutene-1,2-dione
Formula:
C31H26F6N4O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 600.6 g/mol |
|---|---|
| XLogP3 | 6.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 7 |
| Exact Mass | 600.19599506 g/mol |
| Monoisotopic Mass | 600.19599506 g/mol |
| Topological Polar Surface Area | 74.3 Ų |
| Heavy Atom Count | 43 |
| Formal Charge | 0 |
| Complexity | 1120 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 4 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |