866039-86-3
Product Name:
4-(2-HYDROXYETHYL)-2,5-DIMETHYL-1-[(2-NITROPHENYL)SULFONYL]-1,2-DIHYDRO-3H-PYRAZOL-3-ONE
Formula:
C13H15N3O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 341.34 g/mol |
|---|---|
| XLogP3 | 0.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 341.06815638 g/mol |
| Monoisotopic Mass | 341.06815638 g/mol |
| Topological Polar Surface Area | 132 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 633 |
| 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 |