338770-56-2
Product Name:
2-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-2-MORPHOLINO-2-[3-(TRIFLUOROMETHYL)PHENYL]ACETONITRILE
Formula:
C19H14ClF6N3O
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COMPUTED DESCRIPTORS
| Molecular Weight | 449.8 g/mol |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 10 |
| Rotatable Bond Count | 3 |
| Exact Mass | 449.0729587 g/mol |
| Monoisotopic Mass | 449.0729587 g/mol |
| Topological Polar Surface Area | 49.2 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 644 |
| 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 |