80845-35-8
Product Name:
2(1H)-Quinolinone, 3,4-dihydro-1-methyl-6-(1-oxo-3-(4-phenyl-1-piperaz inyl)propyl)-, ethanedioate (1:1)
Formula:
C23H27N3O2.C2H2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 467.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 467.20563565 g/mol |
| Monoisotopic Mass | 467.20563565 g/mol |
| Topological Polar Surface Area | 119 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 624 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |