941933-69-3
Product Name:
2-Thiazoleacetonitrile, α-[[(4-butoxyphenyl)amino]methylene]-4-(4-ethoxy-3-methoxyphenyl)-
Formula:
C25H27N3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 449.6 g/mol |
|---|---|
| XLogP3 | 6.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 11 |
| Exact Mass | 449.17731291 g/mol |
| Monoisotopic Mass | 449.17731291 g/mol |
| Topological Polar Surface Area | 105 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 629 |
| 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 |