6391-41-9
Product Name:
N-[4-[(4-Amino-3-sulfonato-6-sodiosulfo-1-naphthalenyl)[4-(diethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethylethanaminium
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COMPUTED DESCRIPTORS
| Molecular Weight | 632.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 10 |
| Exact Mass | 632.18649747 g/mol |
| Monoisotopic Mass | 632.18649747 g/mol |
| Topological Polar Surface Area | 160 Ų |
| Heavy Atom Count | 43 |
| Formal Charge | 1 |
| Complexity | 1200 |
| 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 |