1037690-33-7
Product Name:
(E)-3-([4-(4-CHLOROPHENYL)-1H-PYRAZOL-5-YL]AMINO)-1-[5-(2,4-DICHLOROPHENYL)-2-FURYL]-2-PROPEN-1-ONE
Formula:
C22H14Cl3N3O2
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COMPUTED DESCRIPTORS
Molecular Weight | 458.7 g/mol |
---|---|
XLogP3 | 7.1 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 457.015160 g/mol |
Monoisotopic Mass | 457.015160 g/mol |
Topological Polar Surface Area | 70.9 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 614 |
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 |