956441-54-6
Product Name:
2-([1-(4-METHYLPHENYL)-1H-PYRAZOL-4-YL]CARBONYL)PHENYL 3-BROMOBENZENECARBOXYLATE
Formula:
C24H17BrN2O3
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COMPUTED DESCRIPTORS
Molecular Weight | 461.3 g/mol |
---|---|
XLogP3 | 5.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 6 |
Exact Mass | 460.04225 g/mol |
Monoisotopic Mass | 460.04225 g/mol |
Topological Polar Surface Area | 61.2 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 607 |
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 |