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1164529-81-0

1164529-81-0 structural image
Product Name: 1-(4-(4-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]PIPERAZINO)PHENYL)-3-(DIMETHYLAMINO)-2-PROPEN-1-ONE
Formula: C21H22ClF3N4O
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COMPUTED DESCRIPTORS

Molecular Weight 438.9 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 438.1434235 g/mol
Monoisotopic Mass 438.1434235 g/mol
Topological Polar Surface Area 39.7 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 600
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