4121-67-9
Product Name:
sodium 2-[2-(2,3-dihydro-1,3-dioxo-1H-inden-2-yl)-6-quinolyl]-6-methylbenzothiazole-7-sulphonate
Formula:
C26H17N2NaO5S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 522.5 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 3 |
| Exact Mass | 522.03200821 g/mol |
| Monoisotopic Mass | 522.03200821 g/mol |
| Topological Polar Surface Area | 154 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 950 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |