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874671-31-5

874671-31-5 structural image
Product Name: 1-(4-(3-CHLORO-5-(TRIFLUOROMETHYL)(2-PYRIDYL))PIPERAZINYL)-2-INDOL-3-YLETHAN-1-ONE
Formula: C20H18ClF3N4O
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COMPUTED DESCRIPTORS

Molecular Weight 422.8 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 422.1121234 g/mol
Monoisotopic Mass 422.1121234 g/mol
Topological Polar Surface Area 52.2 Ų
Heavy Atom Count 29
Formal Charge 0
Complexity 585
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes