500272-24-2
Product Name:
(E)-4-(((3-(4-(tert-butyl)phenyl)-5-mercapto-4H-1,2,4-triazol-4-yl)imino)methyl)phenol
Formula:
C19H20N4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 352.5 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 352.13578245 g/mol |
| Monoisotopic Mass | 352.13578245 g/mol |
| Topological Polar Surface Area | 92.3 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 538 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |