618854-20-9
Product Name:
(5Z)-5-[(3-ethoxy-4-propoxyphenyl)methylidene]-2-(3,4,5-trimethoxyphenyl)-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-one
Formula:
C25H27N3O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 497.6 g/mol |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 10 |
| Exact Mass | 497.16205676 g/mol |
| Monoisotopic Mass | 497.16205676 g/mol |
| Topological Polar Surface Area | 119 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 728 |
| 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 |