370869-82-2
Product Name:
1,3-dimethyl-7-(3-methylbenzyl)-8-((2-oxopropyl)thio)-3,7-dihydro-1H-purine-2,6-dione
Formula:
C18H20N4O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 372.4 g/mol |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 372.12561169 g/mol |
| Monoisotopic Mass | 372.12561169 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 587 |
| 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 |