83399-95-5
Product Name:
2-[[6-[[6-anilino-4-fluoro-1,3,5-triazin-2-yl]amino]-1-hydroxy-3-sulpho-2-naphthyl]azo]-5-methoxybenzene-1,4-disulphonic acid, sodium salt
Formula:
C26H21FN7NaO11S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 787.6 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 19 |
| Rotatable Bond Count | 7 |
| Exact Mass | 786.98252891 g/mol |
| Monoisotopic Mass | 786.98252891 g/mol |
| Topological Polar Surface Area | 314 Ų |
| Heavy Atom Count | 51 |
| Formal Charge | 0 |
| Complexity | 1410 |
| 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 | 4 |
| Compound Is Canonicalized | Yes |