| CAS Number | 1491415-96-3 |
| Catalog Number | AG01EIGI |
| Chemical Name | N-(1,3-benzothiazol-2-yl)-1H-imidazole-4-sulfonamide |
| IUPAC Name | N-(1,3-benzothiazol-2-yl)-1H-imidazole-5-sulfonamide |
| InChI | InChI=1S/C10H8N4O2S2/c15-18(16,9-5-11-6-12-9)14-10-13-7-3-1-2-4-8(7)17-10/h1-6H,(H,11,12)(H,13,14) |
| InChI Key | HBVMULGURZVBCT-UHFFFAOYSA-N |
| MDL Number | MFCD19582373 |
| Molecular Formula | C10H8N4O2S2 |
| Molecular Weight | 280.3261 |
| SMILES | O=S(C1N=CNC=1)(NC1SC2=C(C=CC=C2)N=1)=O |
| Synonyms | AKOS013472800,
N-(1,3-BENZOTHIAZOL-2-YL)-1H-IMIDAZOLE-4-SULFONAMIDE,
1491415-96-3,
|
| Complexity | 397 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 280.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.32g/mol |
| Monoisotopic Mass | 280.009g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 124A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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