2098090-88-9
Product Name:
Thiopyrano[4,3-c]pyrazole-3-carboxylic acid, 2-ethyl-2,4,6,7-tetrahydro-, methyl ester, 5,5-dioxide
Formula:
C10H14N2O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 258.30 g/mol |
|---|---|
| XLogP3 | 0 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 258.06742811 g/mol |
| Monoisotopic Mass | 258.06742811 g/mol |
| Topological Polar Surface Area | 86.6 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 403 |
| 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 |