488102-67-6
Product Name:
4-[(2,4-DICHLOROPHENYL)METHYLIDENEAMINO]-5-PYRIDIN-4-YL-2H-1,2,4-TRIAZOLE-3(4H)-THIONE
Formula:
C14H9Cl2N5S
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COMPUTED DESCRIPTORS
| Molecular Weight | 350.2 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 348.9955719 g/mol |
| Monoisotopic Mass | 348.9955719 g/mol |
| Topological Polar Surface Area | 85 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 478 |
| 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 |