850190-00-0
Product Name:
1'-[(4-fluorophenyl)methyl]-1,6-dimethyl-4',6'-dioxospiro[2,4-dihydro-1H-quinolin-1-ium-3,5'-pyrimidine]-2'-olate
Formula:
C21H20FN3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 381.4 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 381.14886967 g/mol |
| Monoisotopic Mass | 381.14886967 g/mol |
| Topological Polar Surface Area | 69.7 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 663 |
| 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 |