318959-14-7
Product Name:
3-[5-(3-([3-Chloro-5-(trifluoromethyl)-2-pyridinyl]oxy)phenyl)-1H-pyrazol-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine
Formula:
C18H13ClF3N7O
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COMPUTED DESCRIPTORS
| Molecular Weight | 435.8 g/mol |
|---|---|
| XLogP3 | 3.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 435.0822202 g/mol |
| Monoisotopic Mass | 435.0822202 g/mol |
| Topological Polar Surface Area | 96.7 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 589 |
| 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 |