499771-04-9
Product Name:
1-(2,1,3-BENZOTHIADIAZOL-4-YL)-2-BROMO-1-ETHANONE,97%
Formula:
C8H5BrN2OS
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 257.11 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 255.93060 g/mol |
| Monoisotopic Mass | 255.93060 g/mol |
| Topological Polar Surface Area | 71.1 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 214 |
| 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 |