1422065-50-6
Product Name:
rel-(2S,5S)-5-hydroxy-5-methyl-1-(thiophen-3-ylmethyl)piperidine-2-carboxylic acid
Formula:
C12H17NO3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 255.34 g/mol |
|---|---|
| XLogP3 | -1.2 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 255.09291458 g/mol |
| Monoisotopic Mass | 255.09291458 g/mol |
| Topological Polar Surface Area | 89 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 300 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |