896674-36-5
Product Name:
2-[2-(4-chlorophenyl)-5-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]isoindole-1,3-dione
Formula:
C19H10ClN5O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 391.8 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 391.0472169 g/mol |
| Monoisotopic Mass | 391.0472169 g/mol |
| Topological Polar Surface Area | 97.2 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 711 |
| 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 |