883951-48-2
Product Name:
(2Z)-1-(2,6-dichloropyridin-4-yl)-2-(2,3,4,8,9,10-hexahydro-[1,4]dioxepino[2,3-g]isoquinolin-7-ylidene)ethanone
Formula:
C19H16Cl2N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 391.2 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 390.0537978 g/mol |
| Monoisotopic Mass | 390.0537978 g/mol |
| Topological Polar Surface Area | 60.4 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 549 |
| 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 |