860789-31-7
Product Name:
(E)-1-(1,3-BENZODIOXOL-5-YL)-3-[4-(2-PYRIMIDINYLOXY)PHENYL]-2-PROPEN-1-ONE
Formula:
C20H14N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 346.3 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 346.09535693 g/mol |
| Monoisotopic Mass | 346.09535693 g/mol |
| Topological Polar Surface Area | 70.5 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 498 |
| 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 |