400083-93-4
Product Name:
methyl 2-[1-(1,1-dioxo-1lambda6-thiolan-3-yl)-5-oxo-4,5-dihydro-1H-pyrazol-3-yl]acetate
Formula:
C10H14N2O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 274.30 g/mol |
|---|---|
| XLogP3 | -0.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 274.06234272 g/mol |
| Monoisotopic Mass | 274.06234272 g/mol |
| Topological Polar Surface Area | 102 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 505 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |