612826-46-7
Product Name:
N-[(E)-1-(3-bromophenyl)ethylideneamino]-2-[[4-cyclohexyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide
Formula:
C25H28BrN5OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 526.5 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 525.11979 g/mol |
| Monoisotopic Mass | 525.11979 g/mol |
| Topological Polar Surface Area | 97.5 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 665 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |