156054-66-9
Product Name:
N,N-Diethyl-1-ethanaminium 3-(2-[(Z)-(5,5-dimethyl-3-((E)-[1-(3-sulfonatopropyl)naphtho[1,2-d][1,3]thiazol-1-ium-2-yl]methylidene)-1-cyclohexen-1-yl)methylidene]naphtho[1,2-d][1,3]thiazol-1-yl)-1-propanesulfonate
Formula:
C44H53N3O6S4
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COMPUTED DESCRIPTORS
| Molecular Weight | 848.2 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 12 |
| Exact Mass | 847.28172111 g/mol |
| Monoisotopic Mass | 847.28172111 g/mol |
| Topological Polar Surface Area | 192 Ų |
| Heavy Atom Count | 57 |
| Formal Charge | 0 |
| Complexity | 1560 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |