844824-35-7
Product Name:
9-(3,4-dimethylphenyl)-7-hydroxy-1-methyl-3-[(3-methylphenyl)methyl]-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Formula:
C25H27N5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 445.5 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 445.21138974 g/mol |
| Monoisotopic Mass | 445.21138974 g/mol |
| Topological Polar Surface Area | 81.9 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 764 |
| 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 |