442865-10-3
Product Name:
7-(2-ethoxyethyl)-3-methyl-8-((3-oxobutan-2-yl)thio)-3,7-dihydro-1H-purine-2,6-dione
Formula:
C14H20N4O4S
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | >51.1 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 340.40 g/mol |
|---|---|
| XLogP3 | 0.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 340.12052631 g/mol |
| Monoisotopic Mass | 340.12052631 g/mol |
| Topological Polar Surface Area | 119 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 489 |
| 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 |