338749-39-6
Product Name:
2,2,2-TRIFLUORO-1-(2-METHYL-5-[4-(METHYLSULFONYL)PHENYL]-1-[3-(TRIFLUOROMETHYL)PHENYL]-1H-PYRROL-3-YL)-1-ETHANONE
Formula:
C21H15F6NO3S
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COMPUTED DESCRIPTORS
| Molecular Weight | 475.4 g/mol |
|---|---|
| XLogP3 | 5.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 475.06768349 g/mol |
| Monoisotopic Mass | 475.06768349 g/mol |
| Topological Polar Surface Area | 64.5 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 783 |
| 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 |