33956-01-3
Product Name:
N-(1-(6-chloro-2,4-xylyl)-5-oxo-2-pyrazolin-3-yl)-2-(3-pentadecylphenoxy)butyramide
Formula:
C36H52ClN3O3
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COMPUTED DESCRIPTORS
Molecular Weight | 610.3 g/mol |
---|---|
XLogP3 | 12.4 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 20 |
Exact Mass | 609.3697202 g/mol |
Monoisotopic Mass | 609.3697202 g/mol |
Topological Polar Surface Area | 71 Ų |
Heavy Atom Count | 43 |
Formal Charge | 0 |
Complexity | 852 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |