97259-87-5
Product Name:
tetrasodium 1,1'-[[5-[(3,4,5-trimethoxyphenyl)methyl]pyrimidine-2,4-diyl]diimino]bis[3-phenylpropane-1,3-disulphonate]
Formula:
C32H34N4Na4O15S4
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COMPUTED DESCRIPTORS
| Molecular Weight | 934.9 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 19 |
| Rotatable Bond Count | 15 |
| Exact Mass | 934.0494282 g/mol |
| Monoisotopic Mass | 934.0494282 g/mol |
| Topological Polar Surface Area | 340 Ų |
| Heavy Atom Count | 59 |
| Formal Charge | 0 |
| Complexity | 1570 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 5 |
| Compound Is Canonicalized | Yes |