338793-13-8
Product Name:
5-(4-FLUOROPHENYL)-3-HYDROXY-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-2-CYCLOHEXEN-1-ONE
Formula:
C21H20FNO2
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COMPUTED DESCRIPTORS
| Molecular Weight | 337.4 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 337.14780704 g/mol |
| Monoisotopic Mass | 337.14780704 g/mol |
| Topological Polar Surface Area | 49.3 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 538 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |