20328-87-4
Product Name:
2,2'-[(2-carboxy-p-phenylene)bis(iminovinylene)]bis[3-ethyl-4,5-dihydrothiazolium] diiodide
Formula:
C21H28I2N4O2S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 686.4 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 9 |
| Exact Mass | 685.97431 g/mol |
| Monoisotopic Mass | 685.97431 g/mol |
| Topological Polar Surface Area | 118 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 718 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 2 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |