956755-17-2
Product Name:
Pyrazolo[1,5-a]pyrimidine-6-carbonitrile, 3-chloro-2-[1-methyl-5-(trifluoromethyl)-1H-pyrazol-4-yl]-7-(trifluoromethyl)-
Formula:
C13H5ClF6N6
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COMPUTED DESCRIPTORS
| Molecular Weight | 394.66 g/mol |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 1 |
| Exact Mass | 394.0168409 g/mol |
| Monoisotopic Mass | 394.0168409 g/mol |
| Topological Polar Surface Area | 71.8 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 590 |
| 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 |