489-03-2
Product Name:
Butanamide, N-[1-[4-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-1-oxobutyl]amino]phenyl]-4,5-dihydro-5-oxo-1H-pyrazol-3-yl]-2,2,3,3,4,4,4-heptafluoro-
Formula:
C33H39F7N4O4
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 688.7 g/mol |
|---|---|
| XLogP3 | 9.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 13 |
| Exact Mass | 688.28595287 g/mol |
| Monoisotopic Mass | 688.28595287 g/mol |
| Topological Polar Surface Area | 100 Ų |
| Heavy Atom Count | 48 |
| Formal Charge | 0 |
| Complexity | 1200 |
| 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 |