881941-75-9
Product Name:
ethyl 4-((4-(methoxycarbonyl)phenyl)imino)-7-(trifluoromethyl)-1,4-dihydroquinoline-3-carboxylate
Formula:
C21H17F3N2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.4 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 418.11404151 g/mol |
| Monoisotopic Mass | 418.11404151 g/mol |
| Topological Polar Surface Area | 77.5 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 608 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |