318497-74-4
Product Name:
(1-METHYL-3-PHENYL-5-([3-(TRIFLUOROMETHYL)PHENYL]SULFANYL)-1H-PYRAZOL-4-YL)METHYL 3,5-BIS(TRIFLUOROMETHYL)BENZENECARBOXYLATE
Formula:
C27H17F9N2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 604.5 g/mol |
|---|---|
| XLogP3 | 8.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 7 |
| Exact Mass | 604.08670242 g/mol |
| Monoisotopic Mass | 604.08670242 g/mol |
| Topological Polar Surface Area | 69.4 Ų |
| Heavy Atom Count | 41 |
| Formal Charge | 0 |
| Complexity | 856 |
| 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 |