799835-82-8
Product Name:
6-(4-bromophenyl)-10-(methylthio)-7-(p-tolyl)-7,9-dihydro-6H-chromeno[4,3-d][1,2,4]triazolo[1,5-a]pyrimidine
Formula:
C26H21BrN4OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 517.4 g/mol |
|---|---|
| XLogP3 | 6.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 516.06195 g/mol |
| Monoisotopic Mass | 516.06195 g/mol |
| Topological Polar Surface Area | 77.3 Ų |
| Heavy Atom Count | 33 |
| Formal Charge | 0 |
| Complexity | 736 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |