861210-22-2
Product Name:
(E)-2-(4-Chlorobenzoyl)-3-[3-(2-pyrimidinyloxy)phenyl]-2-propenenitrile
Formula:
C20H12ClN3O2
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COMPUTED DESCRIPTORS
| Molecular Weight | 361.8 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 361.0618043 g/mol |
| Monoisotopic Mass | 361.0618043 g/mol |
| Topological Polar Surface Area | 75.9 Ų |
| Heavy Atom Count | 26 |
| Formal Charge | 0 |
| Complexity | 557 |
| 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 |