321998-69-0
Product Name:
1-(2-FLUOROPHENYL)-4-(1-NITRO-2-NAPHTHYL)-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE
Formula:
C20H11F4N3O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 401.3 g/mol |
---|---|
XLogP3 | 5.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 2 |
Exact Mass | 401.07873925 g/mol |
Monoisotopic Mass | 401.07873925 g/mol |
Topological Polar Surface Area | 63.6 Ų |
Heavy Atom Count | 29 |
Formal Charge | 0 |
Complexity | 599 |
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 |