51550-04-0
Product Name:
3-ALLYL-2-MERCAPTOTHIENO[2,3-D]PYRIMIDIN-4(3H)-ONE
Formula:
C9H8N2OS2
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COMPUTED DESCRIPTORS
| Molecular Weight | 224.3 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 224.00780523 g/mol |
| Monoisotopic Mass | 224.00780523 g/mol |
| Topological Polar Surface Area | 92.7 Ų |
| Heavy Atom Count | 14 |
| Formal Charge | 0 |
| Complexity | 293 |
| 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 |