278782-55-1
Product Name:
2-(4-FLUOROBENZYL)-1-OXO-3-PYRIDIN-4-YL-1,2,3,4-TETRAHYDROISOQUINOLINE-4-CARBOXYLIC ACID
Formula:
C22H17FN2O3
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | >56.5 [ug/mL] (The mean of the results at pH 7.4) |
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COMPUTED DESCRIPTORS
Molecular Weight | 376.4 g/mol |
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XLogP3 | 2.7 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 4 |
Exact Mass | 376.12232057 g/mol |
Monoisotopic Mass | 376.12232057 g/mol |
Topological Polar Surface Area | 70.5 Ų |
Heavy Atom Count | 28 |
Formal Charge | 0 |
Complexity | 572 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |