951961-75-4
Product Name:
6-(2-chlorophenyl)-3-[2-(3,4-dimethoxyphenyl)ethyl]-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Formula:
C19H17ClN4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 400.9 g/mol |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 400.0760747 g/mol |
| Monoisotopic Mass | 400.0760747 g/mol |
| Topological Polar Surface Area | 89.8 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 491 |
| 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 |