339100-63-9
Product Name:
ETHYL 4-(4-CHLOROPHENYL)-1-(4-FLUOROPHENYL)-6-METHYL-4,7-DIHYDRO-1H-PYRAZOLO[3,4-B]PYRIDINE-5-CARBOXYLATE
Formula:
C22H19ClFN3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 411.9 g/mol |
---|---|
XLogP3 | 5.1 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 5 |
Rotatable Bond Count | 5 |
Exact Mass | 411.1149827 g/mol |
Monoisotopic Mass | 411.1149827 g/mol |
Topological Polar Surface Area | 56.2 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 630 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |