5-methyl-N-(3-methylpent-1-yn-3-yl)-2,1,3-benzothiadiazole-4-sulfonamide
Chemical Structure Depiction of
5-methyl-N-(3-methylpent-1-yn-3-yl)-2,1,3-benzothiadiazole-4-sulfonamide
5-methyl-N-(3-methylpent-1-yn-3-yl)-2,1,3-benzothiadiazole-4-sulfonamide
Compound characteristics
| Compound ID: | 8013-0924 |
| Compound Name: | 5-methyl-N-(3-methylpent-1-yn-3-yl)-2,1,3-benzothiadiazole-4-sulfonamide |
| Molecular Weight: | 309.41 |
| Molecular Formula: | C13 H15 N3 O2 S2 |
| Smiles: | CCC(C)(C#C)NS(c1c(C)ccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9974 |
| logD: | 2.9893 |
| logSw: | -3.2987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.193 |
| InChI Key: | BGTCMCUPDSOBKO-CYBMUJFWSA-N |