477871-54-8
Product Name:
2-[(Z)-(2-FLUOROPHENYL)METHYLIDENE]-1-AZABICYCLO[2.2.2]OCT-3-YL 4-NITROBENZENECARBOXYLATE
Formula:
C21H19FN2O4
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COMPUTED DESCRIPTORS
Molecular Weight | 382.4 g/mol |
---|---|
XLogP3 | 4.3 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 4 |
Exact Mass | 382.13288525 g/mol |
Monoisotopic Mass | 382.13288525 g/mol |
Topological Polar Surface Area | 75.4 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 618 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |