1020252-71-4
Product Name:
3-((2-(2-AZA-2-ETHOXY-1-METHYLVINYL)PHENOXY)METHYL)-4-BROMO-2-METHYL-1-PHENYL-3-PYRAZOLIN-5-ONE
Formula:
C21H22BrN3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 444.3 g/mol |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 7 |
| Exact Mass | 443.08445 g/mol |
| Monoisotopic Mass | 443.08445 g/mol |
| Topological Polar Surface Area | 54.4 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 616 |
| 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 |