478248-66-7
Product Name:
(E)-2-(2-CHLORO-6-FLUOROBENZYL)-5-(DIMETHYLAMINO)-1-(1-[4-(TRIFLUOROMETHOXY)PHENYL]-1H-1,2,3-TRIAZOL-4-YL)-4-PENTENE-1,3-DIONE
Formula:
C23H19ClF4N4O3
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COMPUTED DESCRIPTORS
Molecular Weight | 510.9 g/mol |
---|---|
XLogP3 | 5.5 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 10 |
Rotatable Bond Count | 9 |
Exact Mass | 510.1081808 g/mol |
Monoisotopic Mass | 510.1081808 g/mol |
Topological Polar Surface Area | 77.3 Ų |
Heavy Atom Count | 35 |
Formal Charge | 0 |
Complexity | 762 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |