63309-35-3
Product Name:
Aripiprazole Related CoMpound (5-(4-broMobutoxy)-3,4-dihydroquinolin-2(1H)-one)
Formula:
C13H16BrNO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 298.18 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 297.03644 g/mol |
| Monoisotopic Mass | 297.03644 g/mol |
| Topological Polar Surface Area | 38.3 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 260 |
| 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 |