339017-51-5
Product Name:
6-[(4-METHOXYPHENYL)SULFANYL]-3-(TRIFLUOROMETHYL)[1,2,4]TRIAZOLO[4,3-B]PYRIDAZINE
Formula:
C13H9F3N4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 326.30 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 326.04491658 g/mol |
| Monoisotopic Mass | 326.04491658 g/mol |
| Topological Polar Surface Area | 77.6 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 379 |
| 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 |