339016-53-4
Product Name:
1-(5-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]METHYL)-2-THIENYL)-2-([5-(3-PYRIDINYL)-1,3,4-OXADIAZOL-2-YL]SULFANYL)-1-ETHANONE
Formula:
C20H12ClF3N4O2S2
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COMPUTED DESCRIPTORS
Molecular Weight | 496.9 g/mol |
---|---|
XLogP3 | 5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 11 |
Rotatable Bond Count | 7 |
Exact Mass | 496.0042302 g/mol |
Monoisotopic Mass | 496.0042302 g/mol |
Topological Polar Surface Area | 135 Ų |
Heavy Atom Count | 32 |
Formal Charge | 0 |
Complexity | 651 |
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 |