318497-71-1
Product Name:
(1-METHYL-3-PHENYL-5-([3-(TRIFLUOROMETHYL)PHENYL]SULFANYL)-1H-PYRAZOL-4-YL)METHYL 4-CYANOBENZENECARBOXYLATE
Formula:
C26H18F3N3O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 493.5 g/mol |
|---|---|
| XLogP3 | 6.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 7 |
| Exact Mass | 493.10718249 g/mol |
| Monoisotopic Mass | 493.10718249 g/mol |
| Topological Polar Surface Area | 93.2 Ų |
| Heavy Atom Count | 35 |
| Formal Charge | 0 |
| Complexity | 759 |
| 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 |