477850-58-1
Product Name:
1-[2-(PHENYLSULFANYL)ACETYL]TETRAHYDRO-3H-PYRAZOL-3-ONE
Formula:
C11H12N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 236.29 g/mol |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 236.06194880 g/mol |
| Monoisotopic Mass | 236.06194880 g/mol |
| Topological Polar Surface Area | 74.7 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 277 |
| 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 |