99479-46-6
Product Name:
5-AMINO-1-[(2-ETHOXY-4-CHLORO-6-FLUORO)PHENYL]-1H-PYRAZOLE-3-CARBONITRILE
Formula:
C13H10Cl2F3N3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 280.68 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 280.0527168 g/mol |
| Monoisotopic Mass | 280.0527168 g/mol |
| Topological Polar Surface Area | 76.9 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 363 |
| 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 |