2-((2-Pyridinylmethyl)thio)-1H-benzimidazole-5-sulphonic acid
2-(pyridin-2-ylmethylsulfanyl)-3H-benzimidazole-5-sulfonic acid
Also Known As: EINECS 248-782-4|2-((2-Pyridinylmethyl)thio)-1H-benzimidazole-5-sulphonic acid|2-[thio]-1h-benzimidazole-5-sulphonicacid|2-[ thio]-1H-benzimidazole-5-sulphonicacid|1h-benzimidazole-5-sulfonic acid, 2-[(2-pyridinylmethyl)thio]-|2-(2-Pyridinylmethyl)thio-1H-benzimidazole-5-sulfonic acid|1H-Benzimidazole-6-sulfonicacid, 2-[(2-pyridinylmethyl)thio]-|2-[(2-Pyridinylmethyl)thio]-1H-benzimidazole-6-sulfonic acid|1H-Benzimidazole-5-sulfonic acid, 2-((2-pyridinylmethyl)thio)-|1H-Benzimidazole-6-sulfonic acid, 2-[(2-pyridinylmethyl)thio]-|2-(pyridin-2-ylmethylsulfanyl)-3H-benzimidazole-5-sulfonic acid|2-[(pyridin-2-ylmethyl)thio]-1h-benzo[d]imidazole-5-sulfonic acid|2-[(2-PYRIDINYLMETHYL)THIO]-1H-BENZIMIDAZOLE-5-SULPHONIC ACID|2-{[(Pyridin-2-yl)methyl]sulfanyl}-1H-1,3-benzimidazole-6-sulfonic acid|2-{[(pyridin-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole-5-sulfonic acid
| Molecular Formula | C13H11N3O3S2 |
|---|---|
| Molecular Weight | 321.02417 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 321.02417 |
| Heavy Atoms | 21 |
| Complexity | 876.1 |
Chemical Identifiers
| CAS Number | 28020-71-5 |
|---|---|
| SMILES | C1=CC=NC(=C1)CSC2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O |
Product Overview
2-((2-Pyridinylmethyl)thio)-1H-benzimidazole-5-sulphonic acid (CAS 28020-71-5), with molecular formula C13H11N3O3S2 and molecular weight 321.02417 g/mol. IUPAC: 2-(pyridin-2-ylmethylsulfanyl)-3H-benzimidazole-5-sulfonic acid.
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