6417-31-8
Product Name:
trisodium 2-[4-[[6-[[[[4-(acetamido)phenyl]amino]carbonyl]amino]-1-hydroxy-3-sulphonato-2-naphthyl]azo]-3-sulphonatophenyl]-6-methylbenzothiazole-7-sulphonate
Formula:
C33H23N6Na3O12S4
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COMPUTED DESCRIPTORS
| Molecular Weight | 892.8 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 6 |
| Exact Mass | 891.99498773 g/mol |
| Monoisotopic Mass | 891.99498773 g/mol |
| Topological Polar Surface Area | 353 Ų |
| Heavy Atom Count | 58 |
| 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 | 0 |
| Covalently-Bonded Unit Count | 4 |
| Compound Is Canonicalized | Yes |