301194-31-0
Product Name:
1-[4-(TERT-BUTYL)PHENYL]-5-(2,4-DICHLOROPHENYL)-3-(4-FLUOROPHENYL)-4,5-DIHYDRO-1H-PYRAZOLE
Formula:
C25H23Cl2FN2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 441.4 g/mol |
---|---|
XLogP3 | 8.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 440.1222323 g/mol |
Monoisotopic Mass | 440.1222323 g/mol |
Topological Polar Surface Area | 15.6 Ų |
Heavy Atom Count | 30 |
Formal Charge | 0 |
Complexity | 603 |
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 |