251307-22-9
Product Name:
3-NITRO-2-(3-[(3-NITRO-2-PYRIDINYL)SULFANYL]-1H-1,2,4-TRIAZOL-1-YL)PYRIDINE
Formula:
C12H7N7O4S
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COMPUTED DESCRIPTORS
| Molecular Weight | 345.30 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 3 |
| Exact Mass | 345.02802290 g/mol |
| Monoisotopic Mass | 345.02802290 g/mol |
| Topological Polar Surface Area | 173 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 473 |
| 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 |