478246-12-7
Product Name:
3-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-1,2,3-BENZOTRIAZIN-4(3H)-ONE
Formula:
C13H6ClF3N4O
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COMPUTED DESCRIPTORS
| Molecular Weight | 326.66 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 1 |
| Exact Mass | 326.0182230 g/mol |
| Monoisotopic Mass | 326.0182230 g/mol |
| Topological Polar Surface Area | 57.9 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 473 |
| 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 |