96989-76-3
Product Name:
2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetic acid
Formula:
C22H28Br2N6O5
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 616.3 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 616.04674 g/mol |
| Monoisotopic Mass | 614.04879 g/mol |
| Topological Polar Surface Area | 154 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 645 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |