896593-32-1
Product Name:
(4E)-4-[[(1-ethylpyrrolidin-2-yl)methylamino]methylidene]-2-(4-fluorophenyl)isoquinoline-1,3-dione
Formula:
C23H24FN3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 393.5 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 393.18525518 g/mol |
| Monoisotopic Mass | 393.18525518 g/mol |
| Topological Polar Surface Area | 56.1 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 657 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |