859860-78-9
Product Name:
2-hydroxy-3-(4-methoxy-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-1,5-dioxaspiro[5.5]undec-2-en-4-one
Formula:
C21H25NO7
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COMPUTED DESCRIPTORS
| Molecular Weight | 403.4 g/mol |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 2 |
| Exact Mass | 403.16310214 g/mol |
| Monoisotopic Mass | 403.16310214 g/mol |
| Topological Polar Surface Area | 86.7 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 689 |
| 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 | 1 |
| Compound Is Canonicalized | Yes |