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Product Name:
1-Piperazinebutanoic acid, 4-[(5-bromo-2-thienyl)sulfonyl]-γ-oxo-
Formula:
C12H15BrN2O5S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 411.3 g/mol |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 5 |
| Exact Mass | 409.96058 g/mol |
| Monoisotopic Mass | 409.96058 g/mol |
| Topological Polar Surface Area | 132 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 528 |
| 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 |