338403-26-2
Product Name:
METHYL 4-(([5-OXO-1-[4-(TRIFLUOROMETHOXY)PHENYL]-3-(TRIFLUOROMETHYL)-1,5-DIHYDRO-4H-PYRAZOL-4-YLIDEN]METHYL)AMINO)BENZENECARBOXYLATE
Formula:
C20H13F6N3O4
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COMPUTED DESCRIPTORS
Molecular Weight | 473.3 g/mol |
---|---|
XLogP3 | 4.9 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 12 |
Rotatable Bond Count | 6 |
Exact Mass | 473.08102488 g/mol |
Monoisotopic Mass | 473.08102488 g/mol |
Topological Polar Surface Area | 80.2 Ų |
Heavy Atom Count | 33 |
Formal Charge | 0 |
Complexity | 795 |
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 |