573694-88-9
Product Name:
4-amino-10-(2-chloro-6-fluorophenyl)-2,5-diimino-8-oxo-2,5,7,8,9,10-hexahydro-1H-thiopyrano[2,3-b:4,5-b']dipyridine-3-carbonitrile
Formula:
C18H12ClFN6OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 414.8 g/mol |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 1 |
| Exact Mass | 414.0465861 g/mol |
| Monoisotopic Mass | 414.0465861 g/mol |
| Topological Polar Surface Area | 167 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 783 |
| 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 |