4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylphenyl)benzamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylphenyl)benzamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylphenyl)benzamide
Compound characteristics
| Compound ID: | C481-0398 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dimethylphenyl)benzamide |
| Molecular Weight: | 452.55 |
| Molecular Formula: | C22 H20 N4 O3 S2 |
| Smiles: | Cc1cccc(c1C)NC(c1ccc(CNS(c2cccc3c2nsn3)(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3606 |
| logD: | 4.3448 |
| logSw: | -4.2787 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.343 |
| InChI Key: | DBMRYQQNPVKGSW-UHFFFAOYSA-N |