947328-30-5
Product Name:
2-Buten-1-one, 3-amino-1-[2-(1,3-dioxolan-2-yl)-6-fluoro-4-(1,1,2,2,2-pentafluoroethyl)-5-(trifluoromethyl)-3-pyridinyl]-, (2Z)-
Formula:
C15H11F9N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 438.24 g/mol |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 4 |
| Exact Mass | 438.06259568 g/mol |
| Monoisotopic Mass | 438.06259568 g/mol |
| Topological Polar Surface Area | 74.4 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 644 |
| 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 |