956940-86-6
Product Name:
(2R,3R)-3-[(E,3S)-3-hydroxyoct-1-enyl]-2-[7-oxo-7-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]heptyl]cyclopentan-1-one
Formula:
C33H50N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 522.8 g/mol |
|---|---|
| XLogP3 | 6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 16 |
| Exact Mass | 522.38214346 g/mol |
| Monoisotopic Mass | 522.38214346 g/mol |
| Topological Polar Surface Area | 60.8 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 735 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |