488853-08-3
Product Name:
2-[[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-naphthalen-1-ylethylideneamino]acetamide
Formula:
C33H33N5OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 547.7 g/mol |
|---|---|
| XLogP3 | 8.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 8 |
| Exact Mass | 547.24058187 g/mol |
| Monoisotopic Mass | 547.24058187 g/mol |
| Topological Polar Surface Area | 97.5 Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 857 |
| 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 |