478078-28-3
Product Name:
(E)-1-(4-BENZYLPIPERAZINO)-3-(6-BROMO-1,3-BENZODIOXOL-5-YL)-2-PROPEN-1-ONE
Formula:
C21H21BrN2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 429.3 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 428.07356 g/mol |
| Monoisotopic Mass | 428.07356 g/mol |
| Topological Polar Surface Area | 42 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 530 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |