5-(4-chlorobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
5-(4-chlorobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-methylbenzene-1-sulfonamide
5-(4-chlorobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 8015-4346 |
| Compound Name: | 5-(4-chlorobenzene-1-sulfonyl)-N-(6-cyano-2H-1,3-benzodioxol-5-yl)-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 490.94 |
| Molecular Formula: | C21 H15 Cl N2 O6 S2 |
| Smiles: | Cc1ccc(cc1S(Nc1cc2c(cc1C#N)OCO2)(=O)=O)S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8887 |
| logD: | 1.5577 |
| logSw: | -4.8483 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.863 |
| InChI Key: | YDCXCMZNXAGMMX-UHFFFAOYSA-N |