361478-22-0
Product Name:
4-(2,3-dichlorophenyl)-2-(methylthio)-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitrile
Formula:
C13H10Cl2N2OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 313.2 g/mol |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 311.9890895 g/mol |
| Monoisotopic Mass | 311.9890895 g/mol |
| Topological Polar Surface Area | 78.2 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 457 |
| 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 |