904766-43-4
Product Name:
2-Butenoic acid, 4-[4-(methylsulfonyl)-1-piperazinyl]-4-oxo-
Formula:
C9H14N2O5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 262.29 g/mol |
|---|---|
| XLogP3 | -1.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 262.06234272 g/mol |
| Monoisotopic Mass | 262.06234272 g/mol |
| Topological Polar Surface Area | 103 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 429 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |