585559-27-9
Product Name:
3-(3-chlorophenyl)-2-phenacylsulfanyl-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-one
Formula:
C25H20ClN3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 462.0 g/mol |
|---|---|
| XLogP3 | 5.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 461.0964758 g/mol |
| Monoisotopic Mass | 461.0964758 g/mol |
| Topological Polar Surface Area | 87.9 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 741 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |