2640496-81-5
Product Name:
Spiro[pyrrolidine-3,4′-[4H]pyrrolo[1,2-b]pyrazole]-1-carboxylic acid, 5′,6′-dihydro-2′-[[(trifluoromethyl)sulfonyl]oxy]-, 1,1-dimethylethyl ester
Formula:
C15H20F3N3O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 411.4 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 411.10757641 g/mol |
| Monoisotopic Mass | 411.10757641 g/mol |
| Topological Polar Surface Area | 99.1 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 703 |
| 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 |