344272-59-9
Product Name:
2,4-Dichlorobenzyl (4-ethyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl)methyl sulfoxide
Formula:
C19H18Cl2N4O3S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 485.4 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 8 |
| Exact Mass | 484.0197382 g/mol |
| Monoisotopic Mass | 484.0197382 g/mol |
| Topological Polar Surface Area | 138 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 593 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |