107859-96-1
Product Name:
4-(5-MERCAPTO-1,3,4-THIADIAZOL-2-YLTHIOMETHYL)-BENZOICACID
Formula:
C10H8N2O2S3
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COMPUTED DESCRIPTORS
| Molecular Weight | 284.4 g/mol |
|---|---|
| XLogP3 | 2.9 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 283.97479102 g/mol |
| Monoisotopic Mass | 283.97479102 g/mol |
| Topological Polar Surface Area | 144 Ų |
| Heavy Atom Count | 17 |
| Formal Charge | 0 |
| Complexity | 352 |
| 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 |