72615-17-9
Product Name:
1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((2-(acetylamino)et henyl)thio)-6-ethyl-7-oxo-, triphenylmethyl ester
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COMPUTED DESCRIPTORS
| Molecular Weight | 538.7 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 10 |
| Exact Mass | 538.19262862 g/mol |
| Monoisotopic Mass | 538.19262862 g/mol |
| Topological Polar Surface Area | 101 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 927 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |