438458-68-5
Product Name:
dimethyl 2,6-dimethyl-4-(1-phenyl-3-(p-tolyl)-1H-pyrazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Formula:
C27H27N3O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 457.5 g/mol |
|---|---|
| XLogP3 | 4.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 7 |
| Exact Mass | 457.20015635 g/mol |
| Monoisotopic Mass | 457.20015635 g/mol |
| Topological Polar Surface Area | 82.4 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 799 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |