400821-62-7
Product Name:
5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one
Formula:
C14H12N2O6S
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COMPUTED DESCRIPTORS
| Molecular Weight | 336.32 g/mol |
|---|---|
| XLogP3 | 0.6 |
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 336.04160728 g/mol |
| Monoisotopic Mass | 336.04160728 g/mol |
| Topological Polar Surface Area | 138 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 592 |
| 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 |