903198-62-9
Product Name:
(2Z)-4-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-6-olate
Formula:
C20H20N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 336.4 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 336.14739250 g/mol |
| Monoisotopic Mass | 336.14739250 g/mol |
| Topological Polar Surface Area | 62.7 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 529 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |