956976-90-2
Product Name:
(2S)-N-(3-chloro-4-methylphenyl)-1-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-5-oxopyrrolidine-2-carboxamide
Formula:
C22H21ClN2O6
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COMPUTED DESCRIPTORS
| Molecular Weight | 444.9 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 5 |
| Exact Mass | 444.1088141 g/mol |
| Monoisotopic Mass | 444.1088141 g/mol |
| Topological Polar Surface Area | 94.2 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 720 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |