475466-15-0
Product Name:
N-(3-hydroxypropyl)-1-(2-oxo-2-thiophen-2-ylethyl)pyridin-1-ium-4-carboxamide perchlorate
Formula:
C15H17ClN2O7S
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COMPUTED DESCRIPTORS
| Molecular Weight | 404.8 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 7 |
| Exact Mass | 404.0444998 g/mol |
| Monoisotopic Mass | 404.0444998 g/mol |
| Topological Polar Surface Area | 176 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 482 |
| 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 | 2 |
| Compound Is Canonicalized | Yes |