303973-56-0
Product Name:
3-methyl-7-(3-methylbenzyl)-8-((2-oxo-2-phenylethyl)thio)-3,7-dihydro-1H-purine-2,6-dione
Formula:
C22H20N4O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 420.5 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 420.12561169 g/mol |
| Monoisotopic Mass | 420.12561169 g/mol |
| Topological Polar Surface Area | 110 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 669 |
| 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 |