383145-78-6
Product Name:
(5-[(4-Methylbenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl)methyl 3-(trifluoromethyl)phenyl ether
Formula:
C24H20F3N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 455.5 g/mol |
|---|---|
| XLogP3 | 6.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 7 |
| Exact Mass | 455.12791793 g/mol |
| Monoisotopic Mass | 455.12791793 g/mol |
| Topological Polar Surface Area | 65.2 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 567 |
| 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 |