494194-50-2
Product Name:
5-(4-BROMO-PHENYL)-4-METHYL-4 H-[1,2,4]TRIAZOLE-3-THIOL
Formula:
C9H8BrN3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 270.15 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 268.96223 g/mol |
| Monoisotopic Mass | 268.96223 g/mol |
| Topological Polar Surface Area | 59.7 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 271 |
| 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 |