52100-32-0
Product Name:
5-BROMO-3,6,6-TRIMETHYL-1-PHENYL-1,5,6,7-TETRAHYDRO-4H-INDAZOL-4-ONE
Formula:
C16H17BrN2O
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 333.22 g/mol |
---|---|
XLogP3 | 4.2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 332.05243 g/mol |
Monoisotopic Mass | 332.05243 g/mol |
Topological Polar Surface Area | 34.9 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 392 |
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 |