836640-92-7
Product Name:
3-(4-methylbenzyl)-11-(3-(trifluoromethyl)phenyl)-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4(11H)-one
Formula:
C27H18F3N5O
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COMPUTED DESCRIPTORS
| Molecular Weight | 485.5 g/mol |
|---|---|
| XLogP3 | 5.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 485.14634470 g/mol |
| Monoisotopic Mass | 485.14634470 g/mol |
| Topological Polar Surface Area | 63.4 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 844 |
| 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 |