851127-24-7
Product Name:
1-(tert-butyl)-3-methyl-4-((2-nitrophenyl)thio)-1H-pyrazol-5-yl 2-(m-tolyl)acetate
Formula:
C23H25N3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 439.5 g/mol |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 439.15657746 g/mol |
| Monoisotopic Mass | 439.15657746 g/mol |
| Topological Polar Surface Area | 115 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 635 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |