1024741-19-2
Product Name:
3-(TERT-BUTYL)-4-((2-(4-CHLOROPHENYLTHIO)-5-NITROPHENYL)METHYLENE)-1-PHENYL-2-PYRAZOLIN-5-ONE
Formula:
C26H22ClN3O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 492.0 g/mol |
|---|---|
| XLogP3 | 7.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 491.1070404 g/mol |
| Monoisotopic Mass | 491.1070404 g/mol |
| Topological Polar Surface Area | 104 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 820 |
| 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 |