620538-60-5
Product Name:
(E)-2-(4-bromophenyl)sulfonyl-3-[2-(2,4-dimethylphenoxy)-9-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Formula:
C26H20BrN3O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 550.4 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 549.03579 g/mol |
| Monoisotopic Mass | 549.03579 g/mol |
| Topological Polar Surface Area | 108 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 1190 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |