1024915-24-9
Product Name:
3-((3,5-BIS(TRIFLUOROMETHYL)PHENYL)AMINO)-2-((2-CHLOROPHENYL)CARBONYL)PROP-2-ENENITRILE
Formula:
C18H9ClF6N2O
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COMPUTED DESCRIPTORS
| Molecular Weight | 418.7 g/mol |
|---|---|
| XLogP3 | 6.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 4 |
| Exact Mass | 418.0307596 g/mol |
| Monoisotopic Mass | 418.0307596 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 28 |
| Formal Charge | 0 |
| Complexity | 629 |
| 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 |