304877-89-2
Product Name:
8-(4-bromophenoxy)-1-[(2-chlorophenyl)methyl]-3,7-dimethylpurine-2,6-dione
Formula:
C20H16BrClN4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 475.7 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 474.00943 g/mol |
| Monoisotopic Mass | 474.00943 g/mol |
| Topological Polar Surface Area | 67.7 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 633 |
| 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 |