955964-55-3
Product Name:
METHYL (E)-3-(3-[1,1'-BIPHENYL]-4-YL-1-PHENYL-1H-PYRAZOL-4-YL)-2-CYANO-2-PROPENOATE
Formula:
C26H19N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 405.4 g/mol |
---|---|
XLogP3 | 5.4 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 405.147726857 g/mol |
Monoisotopic Mass | 405.147726857 g/mol |
Topological Polar Surface Area | 67.9 Ų |
Heavy Atom Count | 31 |
Formal Charge | 0 |
Complexity | 676 |
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 |