956372-18-2
Product Name:
methyl 6a-methyl-4,6-dioxo-5-(2,4,6-trimethylphenyl)-1,3a-dihydropyrrolo[3,4-c]pyrazole-3-carboxylate
Formula:
C17H19N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 329.35 g/mol |
|---|---|
| XLogP3 | 2.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 329.13755610 g/mol |
| Monoisotopic Mass | 329.13755610 g/mol |
| Topological Polar Surface Area | 88.1 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 619 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |