N-(2H-1,3-benzodioxol-5-yl)-4-(methylsulfanyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-4-(methylsulfanyl)benzene-1-sulfonamide
N-(2H-1,3-benzodioxol-5-yl)-4-(methylsulfanyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8016-5640 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-4-(methylsulfanyl)benzene-1-sulfonamide |
| Molecular Weight: | 323.39 |
| Molecular Formula: | C14 H13 N O4 S2 |
| Smiles: | CSc1ccc(cc1)S(Nc1ccc2c(c1)OCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4854 |
| logD: | 3.2343 |
| logSw: | -3.7815 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.004 |
| InChI Key: | HQSCENGNYMABTI-UHFFFAOYSA-N |