1490388-03-8
Product Name:
(S)-N-benzyl-2-(3-(3,5-bis(trifluoroMethyl)phenyl)thioureido)-3,3-diMethylbutanaMide
Formula:
C22H23F6N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 491.5 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 491.14660251 g/mol |
| Monoisotopic Mass | 491.14660251 g/mol |
| Topological Polar Surface Area | 85.2 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 649 |
| 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 |