77563-06-5
Product Name:
6-(1-Methyl-2-(4-phenethylpiperazino)ethyl)amino-2-ethoxybenzothiazole oxalate hydrate (2:4:1)
Formula:
2C24H32N4OS.4C2H2O4.H2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 604.7 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 14 |
| Rotatable Bond Count | 11 |
| Exact Mass | 604.22029991 g/mol |
| Monoisotopic Mass | 604.22029991 g/mol |
| Topological Polar Surface Area | 218 Ų |
| Heavy Atom Count | 42 |
| Formal Charge | 0 |
| Complexity | 567 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 3 |
| Compound Is Canonicalized | Yes |