4-{2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-sulfonyl}-2,1,3-benzothiadiazole
Chemical Structure Depiction of
4-{2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-sulfonyl}-2,1,3-benzothiadiazole
4-{2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-sulfonyl}-2,1,3-benzothiadiazole
Compound characteristics
| Compound ID: | S845-0373 |
| Compound Name: | 4-{2-[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]pyrrolidine-1-sulfonyl}-2,1,3-benzothiadiazole |
| Molecular Weight: | 378.47 |
| Molecular Formula: | C15 H18 N6 O2 S2 |
| Smiles: | CC(C)n1cnnc1C1CCCN1S(c1cccc2c1nsn2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7112 |
| logD: | 1.708 |
| logSw: | -2.0985 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.886 |
| InChI Key: | YWGNKEZSOJLOLL-LBPRGKRZSA-N |