478246-16-1
Product Name:
METHYL 5-CYANO-1-(4-FLUOROPHENYL)-4-[(E)-2-(4-METHOXYANILINO)ETHENYL]-6-OXO-1,6-DIHYDRO-3-PYRIDAZINECARBOXYLATE
Formula:
C22H17FN4O4
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COMPUTED DESCRIPTORS
Molecular Weight | 420.4 g/mol |
---|---|
XLogP3 | 3.3 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 7 |
Exact Mass | 420.12338320 g/mol |
Monoisotopic Mass | 420.12338320 g/mol |
Topological Polar Surface Area | 104 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 828 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |