145785-62-2
Product Name:
N-(3-pyridylmethyl)adriamycin
Formula:
C33H34N2O11
Synonyms:
2-[[3-Ethyl-5-(3-methyl-2(3H)-benzothiazolylidene)-4-oxo-2-thiazolidinylidene]methyl]-1-methyl-pyridinium chloride
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COMPUTED DESCRIPTORS
| Molecular Weight | 634.6 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 6 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 8 |
| Exact Mass | 634.21625990 g/mol |
| Monoisotopic Mass | 634.21625990 g/mol |
| Topological Polar Surface Area | 205 Ų |
| Heavy Atom Count | 46 |
| Formal Charge | 0 |
| Complexity | 1140 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 6 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |