1264298-45-4
Product Name:
N,N-Diethyl-1-ethanaminium 3-(2-[(Z)-2-(2-(diphenylamino)-3-((E)-2-[5-methoxy-3-(3-sulfonatopropyl)-1,3-benzothiazol-3-ium-2-yl]ethenyl)-2-cyclopenten-1-ylidene)ethylidene]-5-methoxy-1,3-benzothiazol-3-yl)-1-propanesulfonate
Formula:
C49H58N4O8S4
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COMPUTED DESCRIPTORS
| Molecular Weight | 959.3 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 18 |
| Exact Mass | 958.31374952 g/mol |
| Monoisotopic Mass | 958.31374952 g/mol |
| Topological Polar Surface Area | 214 Ų |
| Heavy Atom Count | 65 |
| Formal Charge | 0 |
| Complexity | 1720 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 3 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |