16894-31-8
Product Name:
2,2'-[Carbonylbis[imino-1,1'-biphenyl-4,4'-diyl(4,5-dihydro-3-methyl-5-oxo-1H-pyrazole-1,4-diyl)azo]]bis[5-sulfobenzoic acid]tetrasodium salt
Formula:
C47H36N10O13S2
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COMPUTED DESCRIPTORS
| Molecular Weight | 1100.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 19 |
| Rotatable Bond Count | 10 |
| Exact Mass | 1100.11825059 g/mol |
| Monoisotopic Mass | 1100.11825059 g/mol |
| Topological Polar Surface Area | 367 Ų |
| Heavy Atom Count | 76 |
| Formal Charge | 0 |
| Complexity | 2180 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 5 |
| Compound Is Canonicalized | Yes |