618383-07-6
Product Name:
1-(3-CHLORO-4-FLUOROPHENYL)-3-(2,3-DIHYDROBENZO[B][1,4]DIOXIN-7-YL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
Formula:
C18H12ClFN2O4
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COMPUTED DESCRIPTORS
| Molecular Weight | 374.7 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 374.0469627 g/mol |
| Monoisotopic Mass | 374.0469627 g/mol |
| Topological Polar Surface Area | 73.6 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 527 |
| 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 |