24593-59-7
Product Name:
O-benzyl-L-histidine bis(toluene-p-sulphonate)
Formula:
C27H31N3O8S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 589.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 8 |
| Exact Mass | 589.15525730 g/mol |
| Monoisotopic Mass | 589.15525730 g/mol |
| Topological Polar Surface Area | 207 Ų |
| Heavy Atom Count | 40 |
| Formal Charge | 0 |
| Complexity | 473 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |