321571-29-3
Product Name:
Methyl 3-(2-chloro-6-fluorophenyl)-5-[3-(ethoxycarbonyl)-1-(4-fluorophenyl)-1H-pyrazol-4-yl]-4-isoxazolecarboxylate
Formula:
C23H16ClF2N3O5
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COMPUTED DESCRIPTORS
| Molecular Weight | 487.8 g/mol |
|---|---|
| XLogP3 | 4.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 8 |
| Exact Mass | 487.0746546 g/mol |
| Monoisotopic Mass | 487.0746546 g/mol |
| Topological Polar Surface Area | 96.4 Ų |
| Heavy Atom Count | 34 |
| Formal Charge | 0 |
| Complexity | 729 |
| 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 |