956932-25-5
Product Name:
2-(o-tolyloxy)-N-(2,2,2-trichloro-1-((1S,5S)-8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)ethyl)acetamide
Formula:
C22H24Cl3N3O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 484.8 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 483.088325 g/mol |
| Monoisotopic Mass | 483.088325 g/mol |
| Topological Polar Surface Area | 61.9 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 767 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |