489400-06-8
Product Name:
4-(3-bromophenyl)-6-[(4-chlorophenyl)methylsulfanyl]-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile
Formula:
C19H14BrClN2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 433.7 g/mol |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 431.96987 g/mol |
| Monoisotopic Mass | 431.96987 g/mol |
| Topological Polar Surface Area | 78.2 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 579 |
| 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 |