N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
Chemical Structure Depiction of
N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide
Compound characteristics
| Compound ID: | C908-0234 |
| Compound Name: | N-{[5-amino-1-(2,1,3-benzothiadiazole-4-sulfonyl)-1H-1,2,4-triazol-3-yl]methyl}-2,1,3-benzothiadiazole-4-sulfonamide |
| Molecular Weight: | 509.56 |
| Molecular Formula: | C15 H11 N9 O4 S4 |
| Smiles: | C(c1nc(N)n(n1)S(c1cccc2c1nsn2)(=O)=O)NS(c1cccc2c1nsn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2327 |
| logD: | 0.4946 |
| logSw: | -2.201 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 155.779 |
| InChI Key: | ALDBXGHCXQYHFJ-UHFFFAOYSA-N |