126651-85-2
Product Name:
5-(3-bromophenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Formula:
C8H6BrN3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 256.12 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 254.94658 g/mol |
| Monoisotopic Mass | 254.94658 g/mol |
| Topological Polar Surface Area | 68.5 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 254 |
| 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 |