4-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-sulfonyl}-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-sulfonyl}-2,1,3-benzothiadiazole
4-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-sulfonyl}-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | S517-0868 |
| Compound Name: | 4-{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidine-1-sulfonyl}-2,1,3-benzothiadiazole |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C16 H20 N6 O2 S2 |
| Smiles: | CCn1cnnc1CC1CCN(CC1)S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9487 |
| logD: | 1.9473 |
| logSw: | -2.2897 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.959 |
| InChI Key: | HTMFXUYNUGRMKL-UHFFFAOYSA-N |