79449-96-0
Product Name:
3-[2-[4-(4-fluorobenzoyl)piperidino]ethyl]-2,3-dihydro-2-thioxoquinazolin-4(1H)-one [R-(R*,R*)]-tartrate
Formula:
C26H28FN3O8S
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COMPUTED DESCRIPTORS
| Molecular Weight | 561.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 8 |
| Exact Mass | 561.15811420 g/mol |
| Monoisotopic Mass | 561.15811420 g/mol |
| Topological Polar Surface Area | 200 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 763 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |