477710-49-9
Product Name:
ETHYL 3,5-DIMETHYL-1-(5-([3-(TRIFLUOROMETHYL)BENZOYL]AMINO)-2-PYRIDINYL)-1H-PYRAZOLE-4-CARBOXYLATE
Formula:
C21H19F3N4O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 432.4 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 6 |
| Exact Mass | 432.14092497 g/mol |
| Monoisotopic Mass | 432.14092497 g/mol |
| Topological Polar Surface Area | 86.1 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 648 |
| 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 |