383146-82-5
Product Name:
4-ETHYL-3-[(4-METHYLBENZYL)SULFONYL]-5-([3-(TRIFLUOROMETHYL)PHENOXY]METHYL)-4H-1,2,4-TRIAZOLE
Formula:
C20H20F3N3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 439.5 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 439.11774717 g/mol |
| Monoisotopic Mass | 439.11774717 g/mol |
| Topological Polar Surface Area | 82.5 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 648 |
| 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 |