1023873-02-0
Product Name:
4-(4-Methylphenyl)-3-((4-(trifluoromethoxy)phenoxy)methyl)-1,2,4-triazoline-5-thione
Formula:
C17H14F3N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 381.4 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 381.07588236 g/mol |
| Monoisotopic Mass | 381.07588236 g/mol |
| Topological Polar Surface Area | 78.2 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 528 |
| 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 |