956755-40-1
Product Name:
11,12-Dimethoxy-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]-8,9,13b,14-tetrahydro-6H-pyrazolo[5'',1'':2',3']pyrimido[4',5':4,5]pyrido[2,1-a]isoquinolin-6-one
Formula:
C24H21F3N6O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 498.5 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 498.16272304 g/mol |
| Monoisotopic Mass | 498.16272304 g/mol |
| Topological Polar Surface Area | 86.8 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 850 |
| 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 |