303994-45-8
Product Name:
(E)-3-[3-(2-CHLORO-6-FLUOROBENZYL)-2,4-DIISOPROPOXYPHENYL]-2-(PHENYLSULFONYL)-2-PROPENENITRILE
Formula:
C28H27ClFNO4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 528.0 g/mol |
|---|---|
| XLogP3 | 7.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 9 |
| Exact Mass | 527.1333354 g/mol |
| Monoisotopic Mass | 527.1333354 g/mol |
| Topological Polar Surface Area | 84.8 Ų |
| Heavy Atom Count | 36 |
| Formal Charge | 0 |
| Complexity | 887 |
| 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 |