6201-90-7
Product Name:
N-methyl-N-(3-carboxy-4-hydroxyphenylsulfonyl)-1-amino-8-hydroxy-3,6-naphthalenedisulfonic acid
Formula:
C18H15NO12S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 533.5 g/mol |
|---|---|
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 6 |
| Exact Mass | 532.97563843 g/mol |
| Monoisotopic Mass | 532.97563843 g/mol |
| Topological Polar Surface Area | 249 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 1090 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |