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861206-12-4

861206-12-4 structural image
Product Name: 2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-4-(4-METHOXYPHENYL)-5-METHYL-2,4-DIHYDRO-3H-1,2,4-TRIAZOL-3-ONE
Formula: C16H12ClF3N4O2
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COMPUTED DESCRIPTORS

Molecular Weight 384.74 g/mol
XLogP3 3.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 384.0600878 g/mol
Monoisotopic Mass 384.0600878 g/mol
Topological Polar Surface Area 58 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 566
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

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