573943-32-5
Product Name:
isopropyl 2-((4-methyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetate
Formula:
C13H16N4O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 292.36 g/mol |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 292.09939694 g/mol |
| Monoisotopic Mass | 292.09939694 g/mol |
| Topological Polar Surface Area | 95.2 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 330 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |