488093-92-1
Product Name:
7-(4-((3,4-difluorobenzoyl)carbamothioyl)piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Formula:
C24H21F3N4O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 518.5 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 4 |
| Exact Mass | 518.12356082 g/mol |
| Monoisotopic Mass | 518.12356082 g/mol |
| Topological Polar Surface Area | 125 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 929 |
| 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 |