4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclohexane-1-carboxamide
4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | C548-3570 |
| Compound Name: | 4-{[(2,1,3-benzothiadiazole-4-sulfonyl)amino]methyl}-N-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclohexane-1-carboxamide |
| Molecular Weight: | 488.58 |
| Molecular Formula: | C22 H24 N4 O5 S2 |
| Smiles: | C1CC(CCC1CNS(c1cccc2c1nsn2)(=O)=O)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8467 |
| logD: | 2.8451 |
| logSw: | -3.3951 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.056 |
| InChI Key: | RWTJZHWZUUALLO-UHFFFAOYSA-N |