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860651-25-8

860651-25-8 structural image
Product Name: 2,2,2-TRIFLUORO-1-(1-[(4-METHOXYPHENYL)SULFONYL]-1H-PYRROLO[2,3-B]PYRIDIN-3-YL)-1-ETHANONE
Formula: C16H11F3N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 384.3 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 4
Exact Mass 384.03916250 g/mol
Monoisotopic Mass 384.03916250 g/mol
Topological Polar Surface Area 86.6 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 626
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