1147522-06-2
Product Name:
Pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione, 3-[(4-bromophenyl)methyl]-1-methyl-7-(trifluoromethyl)-
Formula:
C16H11BrF3N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 414.18 g/mol |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 412.99867 g/mol |
| Monoisotopic Mass | 412.99867 g/mol |
| Topological Polar Surface Area | 53.5 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 537 |
| 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 |