956925-36-3
Product Name:
(5Z)-1-ethyl-4-methyl-2,6-dioxo-5-[[1-phenyl-3-(4-propan-2-yloxyphenyl)pyrazol-4-yl]methylidene]pyridine-3-carbonitrile
Formula:
C28H26N4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 466.5 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 466.20049070 g/mol |
| Monoisotopic Mass | 466.20049070 g/mol |
| Topological Polar Surface Area | 88.2 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 916 |
| 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 |