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Product Name:
ETHYL 4-[1-(AMINOMETHYL)-2,2,2-TRIFLUOROETHOXY]-1-METHYL-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLATE
Formula:
C13H15F3N4O3
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CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 2 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 332.28 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 6 |
| Exact Mass | 332.10962484 g/mol |
| Monoisotopic Mass | 332.10962484 g/mol |
| Topological Polar Surface Area | 92.3 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 424 |
| 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 |