338953-53-0
Product Name:
2-(4-CHLOROPHENYL)-2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-MORPHOLINOACETONITRILE
Formula:
C18H14Cl2F3N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 416.2 g/mol |
|---|---|
| XLogP3 | 4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 3 |
| Exact Mass | 415.0466020 g/mol |
| Monoisotopic Mass | 415.0466020 g/mol |
| Topological Polar Surface Area | 49.2 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 556 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |