339067-35-5
Product Name:
3-(3-hydroxyoctyl)-4-phenyl-1H-1,2,4-triazole-5-thione
Formula:
C16H23N3OS
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COMPUTED DESCRIPTORS
| Molecular Weight | 305.4 g/mol |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 305.15618354 g/mol |
| Monoisotopic Mass | 305.15618354 g/mol |
| Topological Polar Surface Area | 80 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 367 |
| 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 |