477859-36-2
Product Name:
2,2,2-TRIFLUORO-1-(1-(4-FLUOROPHENYL)-2-METHYL-5-[4-(METHYLSULFONYL)PHENYL]-1H-PYRROL-3-YL)-1-ETHANONE O-METHYLOXIME
Formula:
C21H18F4N2O3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 454.4 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 454.09742626 g/mol |
| Monoisotopic Mass | 454.09742626 g/mol |
| Topological Polar Surface Area | 69 Ų |
| Heavy Atom Count | 31 |
| Formal Charge | 0 |
| Complexity | 737 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |