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257295-47-9

257295-47-9 structural image
Product Name: 2-CHLORO-1-[1-(TRIFLUOROMETHYL)-1,3,4,9-TETRAHYDRO-2H-BETA-CARBOLIN-2-YL]ETHAN-1-ONE
Formula: C14H12ClF3N2O
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COMPUTED DESCRIPTORS

Molecular Weight 316.70 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 316.0590252 g/mol
Monoisotopic Mass 316.0590252 g/mol
Topological Polar Surface Area 36.1 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 418
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes