714943-91-6
Product Name:
1-[(3-fluorophenyl)methyl]-3,7-dimethyl-8-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]purine-2,6-dione
Formula:
C19H17FN6O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 412.4 g/mol |
|---|---|
| XLogP3 | 3.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 412.11177314 g/mol |
| Monoisotopic Mass | 412.11177314 g/mol |
| Topological Polar Surface Area | 111 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 667 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |