1676072-79-9
Product Name:
dimethyl 3,3'-(2,5-dihydroxy-3,6-dioxocyclohexa-1,4-diene-1,4-diyl)bis(3-(1-methyl-1H-pyrazol-4-yl)propanoate)
Formula:
C22H24N4O8
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COMPUTED DESCRIPTORS
| Molecular Weight | 472.4 g/mol |
|---|---|
| XLogP3 | -0.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 10 |
| Exact Mass | 472.15941374 g/mol |
| Monoisotopic Mass | 472.15941374 g/mol |
| Topological Polar Surface Area | 163 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 856 |
| 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 |