321534-65-0
Product Name:
1-BENZYL-5-(1-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-1H-PYRAZOL-5-YL)-3-(4-FLUOROBENZYL)-2,4(1H,3H)-PYRIMIDINEDIONE
Formula:
C27H18ClF4N5O2
Inquiry
COMPUTED DESCRIPTORS
Molecular Weight | 555.9 g/mol |
---|---|
XLogP3 | 4.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 6 |
Exact Mass | 555.1085152 g/mol |
Monoisotopic Mass | 555.1085152 g/mol |
Topological Polar Surface Area | 71.3 Ų |
Heavy Atom Count | 39 |
Formal Charge | 0 |
Complexity | 922 |
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 |