691869-97-3
Product Name:
(E)-3-(DIMETHYLAMINO)-1-[3-(4-METHOXYPHENYL)-2,1-BENZISOXAZOL-5-YL]-2-PROPEN-1-ONE
Formula:
C19H18N2O3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Solubility | 9.3 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
| Molecular Weight | 322.4 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 322.13174244 g/mol |
| Monoisotopic Mass | 322.13174244 g/mol |
| Topological Polar Surface Area | 55.6 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 458 |
| 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 |