175277-94-8
Product Name:
5-[3-(TRIFLUOROMETHYL)BENZYLTHIO]-1,3,4-THIADIAZOLE-2-THIOL
Formula:
C10H7F3N2S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 308.4 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 307.97234624 g/mol |
| Monoisotopic Mass | 307.97234624 g/mol |
| Topological Polar Surface Area | 107 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 357 |
| 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 |