90712-49-5
Product Name:
5-Thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylicacid,7-amino-8-oxo-,[6R-(6alpha,7beta)]-(9CI)
Formula:
C7H8N2O3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 200.22 g/mol |
|---|---|
| XLogP3 | -3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 1 |
| Exact Mass | 200.02556330 g/mol |
| Monoisotopic Mass | 200.02556330 g/mol |
| Topological Polar Surface Area | 109 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 304 |
| 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 |