N-{[3-(1-propyl-1H-benzimidazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
Chemical Structure Depiction of
N-{[3-(1-propyl-1H-benzimidazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
N-{[3-(1-propyl-1H-benzimidazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
Compound characteristics
| Compound ID: | G945-0322 |
| Compound Name: | N-{[3-(1-propyl-1H-benzimidazol-5-yl)-1,2,4-oxadiazol-5-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C19 H17 N7 O3 S2 |
| Smiles: | CCCn1cnc2cc(ccc12)c1nc(CNS(c2cccc3c2nsn3)(=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.3184 |
| logD: | 2.2043 |
| logSw: | -3.6039 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.727 |
| InChI Key: | QUPWMAKIJUMHNQ-UHFFFAOYSA-N |