1029364-73-5
Product Name:
1-Cyclopropyl-1,4-dihydro-6,8-dimethoxy-7-[(4aS,7aS)-octahydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-3-quinolinecarboxylic acid
Formula:
C22H27N3O5
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COMPUTED DESCRIPTORS
Molecular Weight | 413.5 g/mol |
---|---|
XLogP3 | 0.5 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 5 |
Exact Mass | 413.19507097 g/mol |
Monoisotopic Mass | 413.19507097 g/mol |
Topological Polar Surface Area | 91.3 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 738 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 2 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |