478245-36-2
Product Name:
4,6-DIMETHYL-2-[3-(TRIFLUOROMETHYL)PHENOXY]-3-PYRIDINYL 4-METHYLPHENYL SULFONE
Formula:
C21H18F3NO3S
Inquiry
COMPUTED DESCRIPTORS
| Molecular Weight | 421.4 g/mol |
|---|---|
| XLogP3 | 5.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 4 |
| Exact Mass | 421.09594910 g/mol |
| Monoisotopic Mass | 421.09594910 g/mol |
| Topological Polar Surface Area | 64.6 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 641 |
| 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 |