392252-53-8
Product Name:
1H-Pyrazole-1-butanoic acid, 3-(6-bromo-2-methyl-4-phenyl-3-quinolinyl)-5-(2,4-dichlorophenyl)-4,5-dihydro-γ-oxo-
Formula:
C29H22BrCl2N3O3
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 611.3 g/mol |
|---|---|
| XLogP3 | 6.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 609.02216 g/mol |
| Monoisotopic Mass | 609.02216 g/mol |
| Topological Polar Surface Area | 82.9 Ų |
| Heavy Atom Count | 38 |
| Formal Charge | 0 |
| Complexity | 900 |
| 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 |