477713-53-4
Product Name:
3-((E)-3-[2-(4-CHLOROPHENYL)-4-METHYL-1,3-THIAZOL-5-YL]-3-OXO-1-PROPENYL)-1-METHYLPYRIDINIUM IODIDE
Formula:
C19H16ClIN2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 482.8 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 481.97166 g/mol |
| Monoisotopic Mass | 481.97166 g/mol |
| Topological Polar Surface Area | 62.1 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 464 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |