845662-47-7
Product Name:
(E)-1-(3-(1-hydroxynaphthalen-2-yl)-5-phenyl-4,5-dihydro-1H-pyrazol-1-yl)-3-phenylprop-2-en-1-one
Formula:
C28H22N2O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.5 g/mol |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 418.168127949 g/mol |
| Monoisotopic Mass | 418.168127949 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 704 |
| 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 |