60870-40-8
Product Name:
4-(4-BROMO-PHENYL)-5-FURAN-2-YL-4H-[1,2,4]TRIAZOLE-3-THIOL
Formula:
C12H8BrN3OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 322.18 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 320.95715 g/mol |
| Monoisotopic Mass | 320.95715 g/mol |
| Topological Polar Surface Area | 72.9 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 368 |
| 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 |