303152-24-1
Product Name:
3-CYANO-6-(3-METHOXYPHENYL)-2-PYRIDINYL 3-(TRIFLUOROMETHYL)BENZENECARBOXYLATE
Formula:
C21H13F3N2O3
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COMPUTED DESCRIPTORS
| Molecular Weight | 398.3 g/mol |
|---|---|
| XLogP3 | 4.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 5 |
| Exact Mass | 398.08782677 g/mol |
| Monoisotopic Mass | 398.08782677 g/mol |
| Topological Polar Surface Area | 72.2 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 618 |
| 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 |