929968-84-3
Product Name:
6-(5-bromo-3-pyridinyl)-3-tert-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Formula:
C12H12BrN5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 338.23 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 336.99968 g/mol |
| Monoisotopic Mass | 336.99968 g/mol |
| Topological Polar Surface Area | 84.2 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 337 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |